AA06275
1016241-80-7 | 4-Chloro-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA06275
ChemicalName
4-Chloro-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
CasNumber
1016241-80-7
MolecularFormula
C7H4ClN3O2
MolecularWeight
197.5786
MdlNumber
MFCD11518907
Smiles
OC(=O)c1cc2c([nH]1)ncnc2Cl
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AA06275
ChemicalName: 4-Chloro-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
CasNumber: 1016241-80-7
MolecularFormula: C7H4ClN3O2
MolecularWeight: 197.5786
MdlNumber: MFCD11518907
Smiles: OC(=O)c1cc2c([nH]1)ncnc2Cl
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AA06275
ChemicalName:
4-Chloro-7h-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
CasNumber:
1016241-80-7
MolecularFormula:
C7H4ClN3O2
MolecularWeight:
197.5786
MdlNumber:
MFCD11518907
Smiles:
OC(=O)c1cc2c([nH]1)ncnc2Cl
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc2c([nH]1)ncnc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc2c([nH]1)ncnc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA06277
ChemicalName: 2-Amino-4-bromo-5-fluorophenol
CasNumber: 1016234-89-1
MolecularFormula: C6H5BrFNO
MolecularWeight: 206.0124
MdlNumber: MFCD11101429
Smiles: Oc1cc(F)c(cc1N)Br
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
AA06277
ChemicalName:
2-Amino-4-bromo-5-fluorophenol
CasNumber:
1016234-89-1
MolecularFormula:
C6H5BrFNO
MolecularWeight:
206.0124
MdlNumber:
MFCD11101429
Smiles:
Oc1cc(F)c(cc1N)Br
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(Br)c(cc1O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(Br)c(cc1O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__