AB61020
4815-28-5 | 2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Manufacturer: A2B Chem
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CatalogNumber
AB61020
ChemicalName
2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CasNumber
4815-28-5
MolecularFormula
C9H12N2OS
MolecularWeight
196.2694
MdlNumber
MFCD00111277
Smiles
NC(=O)c1c(N)sc2c1CCCC2
NscNumber
153313
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AB61020
ChemicalName: 2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CasNumber: 4815-28-5
MolecularFormula: C9H12N2OS
MolecularWeight: 196.2694
MdlNumber: MFCD00111277
Smiles: NC(=O)c1c(N)sc2c1CCCC2
NscNumber: 153313
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AB61020
ChemicalName:
2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CasNumber:
4815-28-5
MolecularFormula:
C9H12N2OS
MolecularWeight:
196.2694
MdlNumber:
MFCD00111277
Smiles:
NC(=O)c1c(N)sc2c1CCCC2
NscNumber:
153313
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cc(Cl)c(cc1S(=O)(=O)O)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cc(Cl)c(cc1S(=O)(=O)O)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB61022
ChemicalName: 2-Amino-4,5-difluorobenzoic acid
CasNumber: 83506-93-8
MolecularFormula: C7H5F2NO2
MolecularWeight: 173.1169064
MdlNumber: MFCD00077509
Smiles: OC(=O)c1cc(F)c(cc1N)F
NscNumber: __
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB61022
ChemicalName:
2-Amino-4,5-difluorobenzoic acid
CasNumber:
83506-93-8
MolecularFormula:
C7H5F2NO2
MolecularWeight:
173.1169064
MdlNumber:
MFCD00077509
Smiles:
OC(=O)c1cc(F)c(cc1N)F
NscNumber:
__
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(C(=O)C)c(cc1OC)N
NscNumber: __
Complexity: 208
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(C(=O)C)c(cc1OC)N
NscNumber:
__
Complexity:
208
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.4