54714378 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 9 8 8 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 2 2 3 4 4 4 5 5 5 6 6 6 7 9 9 11 11 12 12 13 14 14 15 15 16 17 17 18 18 19 13 8 29 10 7 10 20 7 8 11 8 9 10 12 13 14 15 21 16 22 17 18 23 16 24 25 19 26 19 27 28 1 1 1 2 1 1 1 1 1 2 2 1 1 2 1 2 1 1 1 1 2 1 1 2 1 1 1 1 2 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 7.2641 4.666 6.3981 4.666 3.8 5.5321 3.8 4.666 6.3981 5.5321 2.9061 2.9061 7.2641 6.3981 2 2 8.1301 7.2641 8.1301 4.666 2.9132 2.9132 5.8612 1.4643 1.4643 8.6671 7.2641 8.6671 4.1291 -0.94 1.56 -1.44 -1.44 0.06 0.06 -0.94 0.56 0.56 -0.94 0.5947 -1.4747 0.06 1.56 0.0808 -0.9608 0.56 2.06 1.56 -2.06 1.2146 -2.0946 1.87 0.3929 -1.2729 0.25 2.68 1.87 1.87 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 4 4 5 5 5 6 6 7 9 9 11 12 13 14 15 17 18 7 10 7 8 11 8 10 12 13 14 15 16 17 18 16 19 19 0 Compound Canonicalized 5 2011.12.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 407 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C0723100000000000000000000000000000000000000306080000000000000814000001F00100800000C0C81980830C082C00200880225525000820000212200088801006CC8082632C0959184700866D401C8D90798C8A08E00000000000200000000000000040000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-hydroxy-1H-quinolin-2-one IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-hydroxy-1H-quinolin-2-one IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-hydroxy-1<I>H</I>-quinolin-2-one IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-hydroxy-1H-quinolin-2-one IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-oxidanyl-1H-quinolin-2-one IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 3-(2-fluorophenyl)-4-hydroxy-carbostyril InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C15H10FNO2/c16-11-7-3-1-5-9(11)13-14(18)10-6-2-4-8-12(10)17-15(13)19/h1-8H,(H2,17,18,19) InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 PVNZJQWQALBCRV-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 2.4 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 255.06955672 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C15H10FNO2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 255.24 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 C1=CC=C2C(=C1)C(=C(C(=O)N2)C3=CC=CC=C3F)O SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 C1=CC=C2C(=C1)C(=C(C(=O)N2)C3=CC=CC=C3F)O Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 49.3 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 255.06955672 19 0 0 0 0 0 0 0 1 -1