AV18516
1715031-89-2 | tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)-2-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AV18516
ChemicalName
tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)-2-fluorobenzoate
CasNumber
1715031-89-2
MolecularFormula
C15H15BrFN3O2
MolecularWeight
368.2009
MdlNumber
MFCD28991984
Smiles
Brc1cnc(c(n1)c1ccc(c(c1)F)C(=O)OC(C)(C)C)N
Complexity
405
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.1
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CatalogNumber: AV18516
ChemicalName: tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)-2-fluorobenzoate
CasNumber: 1715031-89-2
MolecularFormula: C15H15BrFN3O2
MolecularWeight: 368.2009
MdlNumber: MFCD28991984
Smiles: Brc1cnc(c(n1)c1ccc(c(c1)F)C(=O)OC(C)(C)C)N
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AV18516
ChemicalName:
tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)-2-fluorobenzoate
CasNumber:
1715031-89-2
MolecularFormula:
C15H15BrFN3O2
MolecularWeight:
368.2009
MdlNumber:
MFCD28991984
Smiles:
Brc1cnc(c(n1)c1ccc(c(c1)F)C(=O)OC(C)(C)C)N
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.1
CatalogNumber: AV18518
ChemicalName: 2-(6-(2-(Trifluoromethyl)phenyl)pyridin-2-yl)acetonitrile
CasNumber: 1261479-61-1
MolecularFormula: C14H9F3N2
MolecularWeight: 262.2299
MdlNumber: MFCD18422482
Smiles: N#CCc1cccc(n1)c1ccccc1C(F)(F)F
Complexity: 344
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AV18518
ChemicalName:
2-(6-(2-(Trifluoromethyl)phenyl)pyridin-2-yl)acetonitrile
CasNumber:
1261479-61-1
MolecularFormula:
C14H9F3N2
MolecularWeight:
262.2299
MdlNumber:
MFCD18422482
Smiles:
N#CCc1cccc(n1)c1ccccc1C(F)(F)F
Complexity:
344
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)Br
Complexity: 363
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)Br
Complexity:
363
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ncc2c(c1)cc(cc2F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ncc2c(c1)cc(cc2F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__