AF57945
383132-31-8 | 5-Bromo-7-chloro-1h-indole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF57945
ChemicalName
5-Bromo-7-chloro-1h-indole-2-carboxylic acid
CasNumber
383132-31-8
MolecularFormula
C9H5BrClNO2
MolecularWeight
274.4985
MdlNumber
MFCD02664433
Smiles
Brc1cc2cc([nH]c2c(c1)Cl)C(=O)O
Complexity
251
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AF57945
ChemicalName: 5-Bromo-7-chloro-1h-indole-2-carboxylic acid
CasNumber: 383132-31-8
MolecularFormula: C9H5BrClNO2
MolecularWeight: 274.4985
MdlNumber: MFCD02664433
Smiles: Brc1cc2cc([nH]c2c(c1)Cl)C(=O)O
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AF57945
ChemicalName:
5-Bromo-7-chloro-1h-indole-2-carboxylic acid
CasNumber:
383132-31-8
MolecularFormula:
C9H5BrClNO2
MolecularWeight:
274.4985
MdlNumber:
MFCD02664433
Smiles:
Brc1cc2cc([nH]c2c(c1)Cl)C(=O)O
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: AF57946
ChemicalName: Ethyl 5-(2-furyl)isoxazole-3-carboxylate
CasNumber: 33545-40-3
MolecularFormula: C10H9NO4
MolecularWeight: 207.1828
MdlNumber: MFCD06797477
Smiles: CCOC(=O)c1noc(c1)c1ccco1
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AF57946
ChemicalName:
Ethyl 5-(2-furyl)isoxazole-3-carboxylate
CasNumber:
33545-40-3
MolecularFormula:
C10H9NO4
MolecularWeight:
207.1828
MdlNumber:
MFCD06797477
Smiles:
CCOC(=O)c1noc(c1)c1ccco1
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc(c1)C1CCCCN1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc(c1)C1CCCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H]1CCCN1Cc1ccccc1
Complexity: 224
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1CCCN1Cc1ccccc1
Complexity:
224
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.4