AA14372
1144037-37-5 | 3,5-Dichlorobenzyl piperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA14372
ChemicalName
3,5-Dichlorobenzyl piperazine-1-carboxylate
CasNumber
1144037-37-5
MolecularFormula
C12H14Cl2N2O2
MolecularWeight
289.1578
MdlNumber
MFCD22384788
Smiles
O=C(N1CCNCC1)OCc1cc(Cl)cc(c1)Cl
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AA14372
ChemicalName: 3,5-Dichlorobenzyl piperazine-1-carboxylate
CasNumber: 1144037-37-5
MolecularFormula: C12H14Cl2N2O2
MolecularWeight: 289.1578
MdlNumber: MFCD22384788
Smiles: O=C(N1CCNCC1)OCc1cc(Cl)cc(c1)Cl
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AA14372
ChemicalName:
3,5-Dichlorobenzyl piperazine-1-carboxylate
CasNumber:
1144037-37-5
MolecularFormula:
C12H14Cl2N2O2
MolecularWeight:
289.1578
MdlNumber:
MFCD22384788
Smiles:
O=C(N1CCNCC1)OCc1cc(Cl)cc(c1)Cl
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.2
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Smiles: COc1ccc(cc1COC(=O)N1CCN(CC1)CCC(=O)c1ccc2c(c1)oc(=O)[nH]2)Cl
Complexity: __
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Smiles:
COc1ccc(cc1COC(=O)N1CCN(CC1)CCC(=O)c1ccc2c(c1)oc(=O)[nH]2)Cl
Complexity:
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Smiles: Fc1cc(COC(=O)N2CCN(CC2)CCC(=O)c2ccc3c(c2)oc(=O)[nH]3)cc(c1)Cl
Complexity: __
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Smiles:
Fc1cc(COC(=O)N2CCN(CC2)CCC(=O)c2ccc3c(c2)oc(=O)[nH]3)cc(c1)Cl
Complexity:
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Covalently-bondedUnitCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Clc1cc(COC(=O)N2CCN(CC2)CCC(=O)c2ccc3c(c2)oc(=O)[nH]3)cc(c1)Cl
Complexity: __
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HydrogenBondDonorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1cc(COC(=O)N2CCN(CC2)CCC(=O)c2ccc3c(c2)oc(=O)[nH]3)cc(c1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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