AB35278
28797-48-0 | 5,11-Dihydro-11-chloroacetyl-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one
Manufacturer: A2B Chem
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CatalogNumber
AB35278
ChemicalName
5,11-Dihydro-11-chloroacetyl-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one
CasNumber
28797-48-0
MolecularFormula
C14H10ClN3O2
MolecularWeight
287.7011
MdlNumber
MFCD01948712
Smiles
ClCC(=O)N1c2ncccc2NC(=O)c2c1cccc2
Complexity
404
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AB35278
ChemicalName: 5,11-Dihydro-11-chloroacetyl-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one
CasNumber: 28797-48-0
MolecularFormula: C14H10ClN3O2
MolecularWeight: 287.7011
MdlNumber: MFCD01948712
Smiles: ClCC(=O)N1c2ncccc2NC(=O)c2c1cccc2
Complexity: 404
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AB35278
ChemicalName:
5,11-Dihydro-11-chloroacetyl-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one
CasNumber:
28797-48-0
MolecularFormula:
C14H10ClN3O2
MolecularWeight:
287.7011
MdlNumber:
MFCD01948712
Smiles:
ClCC(=O)N1c2ncccc2NC(=O)c2c1cccc2
Complexity:
404
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: AB35283
ChemicalName: Isothiazole
CasNumber: 288-16-4
MolecularFormula: C3H3NS
MolecularWeight: 85.1276
MdlNumber: MFCD00020818
Smiles: c1ccns1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB35283
ChemicalName:
Isothiazole
CasNumber:
288-16-4
MolecularFormula:
C3H3NS
MolecularWeight:
85.1276
MdlNumber:
MFCD00020818
Smiles:
c1ccns1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccno1
Complexity: 30.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccno1
Complexity:
30.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccn[nH]1
Complexity: 28.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccn[nH]1
Complexity:
28.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3