CID 26058061
PubChem CID
26058061
Structure
Molecular Formula
Status
Non-live
Molecular Weight
288.43 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
[(2R)-butan-2-yl]-[2-[2-[[2-[[(2S)-butan-2-yl]azaniumyl]acetyl]amino]ethylamino]-2-oxoethyl]azanium
InChI=1S/C14H30N4O2/c1-5-11(3)17-9-13(19)15-7-8-16-14(20)10-18-12(4)6-2/h11-12,17-18H,5-10H2,1-4H3,(H,15,19)(H,16,20)/p+2/t11-,12+
LWTSIRLKGMVTDI-TXEJJXNPSA-P
CC[C@@H](C)[NH2+]CC(=O)NCCNC(=O)C[NH2+][C@@H](C)CC
C14H32N4O2+2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
288.43 g/mol
Property Name
XLogP3-AA
Property Value
0.7
Property Name
Hydrogen Bond Donor Count
Property Value
4
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
11
Property Name
Exact Mass
Property Value
288.25252628 g/mol
Property Name
Monoisotopic Mass
Property Value
288.25252628 g/mol
Property Name
Topological Polar Surface Area
Property Value
91.4 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
2
Property Name
Complexity
Property Value
256
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
2
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
CONTENTS