AI59727
889658-85-9 | 3-Bromo-1h-pyrrolo[3,2-b]pyridine-2-carboxylic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI59727
ChemicalName
3-Bromo-1h-pyrrolo[3,2-b]pyridine-2-carboxylic acid ethyl ester
CasNumber
889658-85-9
MolecularFormula
C10H9BrN2O2
MolecularWeight
269.09466000000003
MdlNumber
MFCD16657746
Smiles
CCOC(=O)c1[nH]c2c(c1Br)nccc2
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AI59727
ChemicalName: 3-Bromo-1h-pyrrolo[3,2-b]pyridine-2-carboxylic acid ethyl ester
CasNumber: 889658-85-9
MolecularFormula: C10H9BrN2O2
MolecularWeight: 269.09466000000003
MdlNumber: MFCD16657746
Smiles: CCOC(=O)c1[nH]c2c(c1Br)nccc2
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AI59727
ChemicalName:
3-Bromo-1h-pyrrolo[3,2-b]pyridine-2-carboxylic acid ethyl ester
CasNumber:
889658-85-9
MolecularFormula:
C10H9BrN2O2
MolecularWeight:
269.09466000000003
MdlNumber:
MFCD16657746
Smiles:
CCOC(=O)c1[nH]c2c(c1Br)nccc2
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc2c(c1)cc(cn2)I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1ccc2c(c1)cc(cn2)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1cnc(s1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)c1cnc(s1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(S(=O)(=O)Oc1ccc(cc1)Cc1ccc(cc1)OS(=O)(=O)C(F)(F)F)(F)F
Complexity: 670
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(S(=O)(=O)Oc1ccc(cc1)Cc1ccc(cc1)OS(=O)(=O)C(F)(F)F)(F)F
Complexity:
670
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.3