AI34070
1400645-27-3 | 1-(3-Chloro-pyrazin-2-yl)-piperidine-4-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI34070
ChemicalName
1-(3-Chloro-pyrazin-2-yl)-piperidine-4-carboxylic acid methyl ester
CasNumber
1400645-27-3
MolecularFormula
C11H14ClN3O2
MolecularWeight
255.7008
MdlNumber
MFCD07368263
Smiles
COC(=O)C1CCN(CC1)c1nccnc1Cl
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
1.5
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CatalogNumber: AI34070
ChemicalName: 1-(3-Chloro-pyrazin-2-yl)-piperidine-4-carboxylic acid methyl ester
CasNumber: 1400645-27-3
MolecularFormula: C11H14ClN3O2
MolecularWeight: 255.7008
MdlNumber: MFCD07368263
Smiles: COC(=O)C1CCN(CC1)c1nccnc1Cl
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1.5
CatalogNumber:
AI34070
ChemicalName:
1-(3-Chloro-pyrazin-2-yl)-piperidine-4-carboxylic acid methyl ester
CasNumber:
1400645-27-3
MolecularFormula:
C11H14ClN3O2
MolecularWeight:
255.7008
MdlNumber:
MFCD07368263
Smiles:
COC(=O)C1CCN(CC1)c1nccnc1Cl
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1.5
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Smiles: CC(=CS(=O)C(C)(C)C)C(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(=CS(=O)C(C)(C)C)C(C)C
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: N#Cc1cnc2c(c1)CCC2=O
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Smiles:
N#Cc1cnc2c(c1)CCC2=O
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: OC(=O)c1cnn2c(c1Cl)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cnn2c(c1Cl)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__