CID 51843798
PubChem CID
51843798
Structure
Molecular Formula
Status
Non-live
Molecular Weight
384.5 g/mol
Dates
- Create:2011-05-20
Chemical Structure Depiction
(2R,3R)-N-tert-butyl-2-[(5-methylfuran-2-yl)methyl-propanoylamino]-3-phenylbutanamide
InChI=1S/C23H32N2O3/c1-7-20(26)25(15-19-14-13-16(2)28-19)21(22(27)24-23(4,5)6)17(3)18-11-9-8-10-12-18/h8-14,17,21H,7,15H2,1-6H3,(H,24,27)/t17-,21-/m1/s1
QIRVCNIXORARHQ-DYESRHJHSA-N
CCC(=O)N(CC1=CC=C(O1)C)[C@H]([C@H](C)C2=CC=CC=C2)C(=O)NC(C)(C)C
C23H32N2O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
384.5 g/mol
Property Name
XLogP3-AA
Property Value
3.8
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
8
Property Name
Exact Mass
Property Value
384.24129289 g/mol
Property Name
Monoisotopic Mass
Property Value
384.24129289 g/mol
Property Name
Topological Polar Surface Area
Property Value
62.6 A^2
Property Name
Heavy Atom Count
Property Value
28
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
522
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
CONTENTS