AA53649
1216708-87-0 | Ethyl 3-amino-6-bromobenzothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA53649
ChemicalName
Ethyl 3-amino-6-bromobenzothiophene-2-carboxylate
CasNumber
1216708-87-0
MolecularFormula
C11H10BrNO2S
MolecularWeight
300.1716
MdlNumber
MFCD11505028
Smiles
CCOC(=O)c1sc2c(c1N)ccc(c2)Br
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.1
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CatalogNumber: AA53649
ChemicalName: Ethyl 3-amino-6-bromobenzothiophene-2-carboxylate
CasNumber: 1216708-87-0
MolecularFormula: C11H10BrNO2S
MolecularWeight: 300.1716
MdlNumber: MFCD11505028
Smiles: CCOC(=O)c1sc2c(c1N)ccc(c2)Br
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.1
CatalogNumber:
AA53649
ChemicalName:
Ethyl 3-amino-6-bromobenzothiophene-2-carboxylate
CasNumber:
1216708-87-0
MolecularFormula:
C11H10BrNO2S
MolecularWeight:
300.1716
MdlNumber:
MFCD11505028
Smiles:
CCOC(=O)c1sc2c(c1N)ccc(c2)Br
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.1
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MolecularFormula: __
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Smiles: OC(=O)Cc1cn2c(n1)cc(cc2)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
OC(=O)Cc1cn2c(n1)cc(cc2)Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: NNc1ccc(cc1)CCS(=O)(=O)NC
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Smiles:
NNc1ccc(cc1)CCS(=O)(=O)NC
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: CNS(=O)(=O)CCc1ccc2c(c1)c(c[nH]2)C1=CCN(CC1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNS(=O)(=O)CCc1ccc2c(c1)c(c[nH]2)C1=CCN(CC1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__