AB45210
849068-61-7 | 5-Bromo-1h-pyrrolo[2,3-b]pyridine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB45210
ChemicalName
5-Bromo-1h-pyrrolo[2,3-b]pyridine-3-carboxylic acid
CasNumber
849068-61-7
MolecularFormula
C8H5BrN2O2
MolecularWeight
241.0415
MdlNumber
MFCD09965908
Smiles
OC(=O)c1c[nH]c2c1cc(Br)cn2
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AB45210
ChemicalName: 5-Bromo-1h-pyrrolo[2,3-b]pyridine-3-carboxylic acid
CasNumber: 849068-61-7
MolecularFormula: C8H5BrN2O2
MolecularWeight: 241.0415
MdlNumber: MFCD09965908
Smiles: OC(=O)c1c[nH]c2c1cc(Br)cn2
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB45210
ChemicalName:
5-Bromo-1h-pyrrolo[2,3-b]pyridine-3-carboxylic acid
CasNumber:
849068-61-7
MolecularFormula:
C8H5BrN2O2
MolecularWeight:
241.0415
MdlNumber:
MFCD09965908
Smiles:
OC(=O)c1c[nH]c2c1cc(Br)cn2
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCCC=C
Complexity: 32.9
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCCC=C
Complexity:
32.9
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: AB45212
ChemicalName: (5-Bromopyrimidin-2-yl)methanol
CasNumber: 22433-12-1
MolecularFormula: C5H5BrN2O
MolecularWeight: 189.01
MdlNumber: MFCD16610245
Smiles: OCc1ncc(cn1)Br
Complexity: 83
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB45212
ChemicalName:
(5-Bromopyrimidin-2-yl)methanol
CasNumber:
22433-12-1
MolecularFormula:
C5H5BrN2O
MolecularWeight:
189.01
MdlNumber:
MFCD16610245
Smiles:
OCc1ncc(cn1)Br
Complexity:
83
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSc1ncc(c(n1)C(=O)O)Br
Complexity: 181
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSc1ncc(c(n1)C(=O)O)Br
Complexity:
181
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6