Products for Research Use Only
RegisterLogin

BMS-764459

CAT: 0931-T26856-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T26856-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1188407-45-5
Target
Cytochromes P450, CRFR, Others
Related Pathways
Others, Metabolism, GPCR/G Protein
Bioactivity
BMS-764459 is a potent antagonist of corticotropin-releasing factor/hormone receptor 1 (CRHR-1) .
Smiles
[C@H](COC)(N1C(=O)C(NC2=C(C)N=C(OC(F)F)C(C)=C2)=NC(C#N)=C1)C3CC3
Molecular Formula
C19H21F2N5O3
Molecular Weight
405.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Pyrazinecarbonitrile,4-[(1S)-1-cyclopropyl-2-methoxyethyl]-6-[[6-(difluoromethoxy)-2,5-dimethyl-3-pyridinyl]amino]-4,5-dihydro-5-oxo-
CAS Number1188407-45-5
PubChem CID44160264
IUPAC Name4-[(1S)-1-cyclopropyl-2-methoxyethyl]-6-[[6-(difluoromethoxy)-2,5-dimethyl-3-pyridinyl]amino]-5-oxopyrazine-2-carbonitrile
Molecular FormulaC19H21F2N5O3
Molecular Weight405.4
XLogP2.4
Topological Polar Surface Area99.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity731
SMILES
CC1=CC(=C(N=C1OC(F)F)C)NC2=NC(=CN(C2=O)[C@H](COC)C3CC3)C#N
InChI
InChI=1S/C19H21F2N5O3/c1-10-6-14(11(2)23-17(10)29-19(20)21)25-16-18(27)26(8-13(7-22)24-16)15(9-28-3)12-4-5-12/h6,8,12,15,19H,4-5,9H2,1-3H3,(H,24,25)/t15-/m1/s1
InChIKey
PJMUNXORSUNUCV-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of 2-Pyrazinecarbonitrile,4-[(1S)-1-cyclopropyl-2-methoxyethyl]-6-[[6-(difluoromethoxy)-2,5-dimethyl-3-pyridinyl]amino]-4,5-dihydro-5-oxo-
CAS: 1188407-45-5
CID: 44160264
Formula: C19H21F2N5O3
MW: 405.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight405.4
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass405.16124587
Monoisotopic Mass405.16124587
Topological Polar Surface Area99.8 Ų
Heavy Atom Count29
Formal Charge0
Complexity731
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T9901A-878-01BMS-986156
T38397BMS-753426
T26858BMS-770767
T70864-01BMS-883559
T70450-01BMS-870145
T70285-01BMS-200
T69686-01BMS-986318
T69523-01BMS-681
T69371-01BMS 378806
T69221-01BMS-554417

Alternative Products

CatalogName
HY-14225BMS-764459
MBS386661-01BMS-806 (BMS 378806)
A11201-2BMS-806 (BMS 378806) 2mg
A11201-1BMS-806 (BMS 378806) 1mg
A11201-25BMS-806 (BMS 378806) 25mg
A11201-500BMS-806 (BMS 378806) 500mg
BA1866-5BMS-986094
BA9174-50BMS-564929
BA5455-5BMS-986278
BA5193-5BMS-986224

Popular Products