AA97603
182181-38-0 | 3-Fluoro-4-piperazinylbenzenecarbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA97603
ChemicalName
3-Fluoro-4-piperazinylbenzenecarbonitrile
CasNumber
182181-38-0
MolecularFormula
C11H12FN3
MolecularWeight
205.2315
MdlNumber
MFCD03043990
Smiles
N#Cc1ccc(c(c1)F)N1CCNCC1
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AA97603
ChemicalName: 3-Fluoro-4-piperazinylbenzenecarbonitrile
CasNumber: 182181-38-0
MolecularFormula: C11H12FN3
MolecularWeight: 205.2315
MdlNumber: MFCD03043990
Smiles: N#Cc1ccc(c(c1)F)N1CCNCC1
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AA97603
ChemicalName:
3-Fluoro-4-piperazinylbenzenecarbonitrile
CasNumber:
182181-38-0
MolecularFormula:
C11H12FN3
MolecularWeight:
205.2315
MdlNumber:
MFCD03043990
Smiles:
N#Cc1ccc(c(c1)F)N1CCNCC1
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: __
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Smiles: N#Cc1cc(Cl)ccc1N1CCNCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N#Cc1cc(Cl)ccc1N1CCNCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: NN=Cc1cccc(c1)C(=O)OC.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NN=Cc1cccc(c1)C(=O)OC.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Nc1ccc(cc1)C(=O)N1CCc2c(-c3c1cccc3)[nH]c(n2)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)C(=O)N1CCc2c(-c3c1cccc3)[nH]c(n2)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__