AB70081
68077-26-9 | 7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB70081
ChemicalName
7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber
68077-26-9
MolecularFormula
C12H9ClFNO3
MolecularWeight
269.6561632
MdlNumber
MFCD00792459
Smiles
CCn1cc(C(=O)O)c(=O)c2c1cc(Cl)c(c2)F
Complexity
412
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AB70081
ChemicalName: 7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber: 68077-26-9
MolecularFormula: C12H9ClFNO3
MolecularWeight: 269.6561632
MdlNumber: MFCD00792459
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(Cl)c(c2)F
Complexity: 412
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB70081
ChemicalName:
7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber:
68077-26-9
MolecularFormula:
C12H9ClFNO3
MolecularWeight:
269.6561632
MdlNumber:
MFCD00792459
Smiles:
CCn1cc(C(=O)O)c(=O)c2c1cc(Cl)c(c2)F
Complexity:
412
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1cc2NC(=O)COc2cn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1cc2NC(=O)COc2cn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB70083
ChemicalName: 7-Chloro-1H-pyrrolo[2,3-c]pyridine
CasNumber: 357263-41-3
MolecularFormula: C7H5ClN2
MolecularWeight: 152.581
MdlNumber: MFCD03839905
Smiles: Clc1nccc2c1[nH]cc2
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
AB70083
ChemicalName:
7-Chloro-1H-pyrrolo[2,3-c]pyridine
CasNumber:
357263-41-3
MolecularFormula:
C7H5ClN2
MolecularWeight:
152.581
MdlNumber:
MFCD03839905
Smiles:
Clc1nccc2c1[nH]cc2
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: AB70084
ChemicalName: 7-Chloroindole-2-boronic acid, pinacol ester
CasNumber: 936901-92-7
MolecularFormula: C14H17BClNO2
MolecularWeight: 277.5543
MdlNumber: MFCD16295113
Smiles: Clc1cccc2c1[nH]c(c2)B1OC(C(O1)(C)C)(C)C
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB70084
ChemicalName:
7-Chloroindole-2-boronic acid, pinacol ester
CasNumber:
936901-92-7
MolecularFormula:
C14H17BClNO2
MolecularWeight:
277.5543
MdlNumber:
MFCD16295113
Smiles:
Clc1cccc2c1[nH]c(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
__