AI32103
1355247-62-9 | Methyl 3-cyclopropylbenzimidazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI32103
ChemicalName
Methyl 3-cyclopropylbenzimidazole-5-carboxylate
CasNumber
1355247-62-9
MolecularFormula
C12H12N2O2
MolecularWeight
216.2359
MdlNumber
MFCD21332959
Smiles
COC(=O)c1ccc2c(c1)n(cn2)C1CC1
Complexity
291
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AI32103
ChemicalName: Methyl 3-cyclopropylbenzimidazole-5-carboxylate
CasNumber: 1355247-62-9
MolecularFormula: C12H12N2O2
MolecularWeight: 216.2359
MdlNumber: MFCD21332959
Smiles: COC(=O)c1ccc2c(c1)n(cn2)C1CC1
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AI32103
ChemicalName:
Methyl 3-cyclopropylbenzimidazole-5-carboxylate
CasNumber:
1355247-62-9
MolecularFormula:
C12H12N2O2
MolecularWeight:
216.2359
MdlNumber:
MFCD21332959
Smiles:
COC(=O)c1ccc2c(c1)n(cn2)C1CC1
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: AI32104
ChemicalName: 2-Pyrrolidino-3-trifluoromethylpyridine
CasNumber: 1355247-70-9
MolecularFormula: C10H11F3N2
MolecularWeight: 216.2029
MdlNumber: MFCD21333045
Smiles: FC(c1cccnc1N1CCCC1)(F)F
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AI32104
ChemicalName:
2-Pyrrolidino-3-trifluoromethylpyridine
CasNumber:
1355247-70-9
MolecularFormula:
C10H11F3N2
MolecularWeight:
216.2029
MdlNumber:
MFCD21333045
Smiles:
FC(c1cccnc1N1CCCC1)(F)F
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc2c(c1)n(cn2)C1CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc2c(c1)n(cn2)C1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI32106
ChemicalName: Ethyl 4-iodo-1-(4-methoxybenzyl)-1h-pyrazole-3-carboxylate
CasNumber: 1355249-29-4
MolecularFormula: C14H15IN2O3
MolecularWeight: 386.185
MdlNumber: MFCD30180245
Smiles: CCOC(=O)c1nn(cc1I)Cc1ccc(cc1)OC
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 6
Xlogp3: 3
CatalogNumber:
AI32106
ChemicalName:
Ethyl 4-iodo-1-(4-methoxybenzyl)-1h-pyrazole-3-carboxylate
CasNumber:
1355249-29-4
MolecularFormula:
C14H15IN2O3
MolecularWeight:
386.185
MdlNumber:
MFCD30180245
Smiles:
CCOC(=O)c1nn(cc1I)Cc1ccc(cc1)OC
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
6
Xlogp3:
3