AI39337
1781783-46-7 | 3-Amino-6-bromo-1-benzothiophene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI39337
ChemicalName
3-Amino-6-bromo-1-benzothiophene-2-carboxylic acid
CasNumber
1781783-46-7
MolecularFormula
C9H6BrNO2S
MolecularWeight
272.1184
MdlNumber
MFCD26131166
Smiles
Brc1ccc2c(c1)sc(c2N)C(=O)O
Complexity
251
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
3.4
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CatalogNumber: AI39337
ChemicalName: 3-Amino-6-bromo-1-benzothiophene-2-carboxylic acid
CasNumber: 1781783-46-7
MolecularFormula: C9H6BrNO2S
MolecularWeight: 272.1184
MdlNumber: MFCD26131166
Smiles: Brc1ccc2c(c1)sc(c2N)C(=O)O
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3.4
CatalogNumber:
AI39337
ChemicalName:
3-Amino-6-bromo-1-benzothiophene-2-carboxylic acid
CasNumber:
1781783-46-7
MolecularFormula:
C9H6BrNO2S
MolecularWeight:
272.1184
MdlNumber:
MFCD26131166
Smiles:
Brc1ccc2c(c1)sc(c2N)C(=O)O
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(Br)c(cc1F)O
Complexity: 188
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(Br)c(cc1F)O
Complexity:
188
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(Br)cc(c1O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(Br)cc(c1O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)NC(c1ccc(cc1)Br)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)NC(c1ccc(cc1)Br)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__