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BMS-929075

CAT: 1410-M34188-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M34188-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BMS-929075 is an orally active HCV NS5B replicase (HCV NS5B replicase) palm site variant inhibitor with potency, high oral bioavailability and pharmacokinetic parameters.BMS-929075 shows cytotoxicity.
CAS Number
1217338-97-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
538.54
Molecular Formula
C31H24F2N4O3
Notes
Research use only, not for human use.
Receptor
HCV Protease

Chemical Information

Bms-929075

BMS-929075 is under investigation in clinical trial NCT01525212 (Multiple Ascending Dose Study of BMS-929075 in Hepatitis C Virus (HCV) Infected Patients).

CAS Number1217338-97-0
PubChem CID59275404
IUPAC Name4-fluoro-2-(4-fluorophenyl)-N-methyl-5-[2-methyl-5-[(1-pyrimidin-2-ylcyclopropyl)carbamoyl]phenyl]-1-benzofuran-3-carboxamide
Molecular FormulaC31H24F2N4O3
Molecular Weight538.5
XLogP4.9
Topological Polar Surface Area97.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count40
Formal Charge0
Complexity920
SMILES
CC1=C(C=C(C=C1)C(=O)NC2(CC2)C3=NC=CC=N3)C4=C(C5=C(C=C4)OC(=C5C(=O)NC)C6=CC=C(C=C6)F)F
InChI
InChI=1S/C31H24F2N4O3/c1-17-4-5-19(28(38)37-31(12-13-31)30-35-14-3-15-36-30)16-22(17)21-10-11-23-24(26(21)33)25(29(39)34-2)27(40-23)18-6-8-20(32)9-7-18/h3-11,14-16H,12-13H2,1-2H3,(H,34,39)(H,37,38)
InChIKey
LZAUGCMVNLZVJV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bms-929075
CAS: 1217338-97-0
CID: 59275404
Formula: C31H24F2N4O3
MW: 538.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight538.5
XLogP34.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass538.18164696
Monoisotopic Mass538.18164696
Topological Polar Surface Area97.1 Ų
Heavy Atom Count40
Formal Charge0
Complexity920
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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