AF18841
1977-07-7 | 11-(4-Methyl-1-piperazinyl)-5h-dibenzo(b,e)(1,4)diazepine
Manufacturer: A2B Chem
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CatalogNumber
AF18841
ChemicalName
11-(4-Methyl-1-piperazinyl)-5h-dibenzo(b,e)(1,4)diazepine
CasNumber
1977-07-7
MolecularFormula
C18H20N4
MolecularWeight
292.3782
MdlNumber
MFCD01730958
Smiles
CN1CCN(CC1)C1=Nc2ccccc2Nc2c1cccc2
Complexity
413
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AF18841
ChemicalName: 11-(4-Methyl-1-piperazinyl)-5h-dibenzo(b,e)(1,4)diazepine
CasNumber: 1977-07-7
MolecularFormula: C18H20N4
MolecularWeight: 292.3782
MdlNumber: MFCD01730958
Smiles: CN1CCN(CC1)C1=Nc2ccccc2Nc2c1cccc2
Complexity: 413
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AF18841
ChemicalName:
11-(4-Methyl-1-piperazinyl)-5h-dibenzo(b,e)(1,4)diazepine
CasNumber:
1977-07-7
MolecularFormula:
C18H20N4
MolecularWeight:
292.3782
MdlNumber:
MFCD01730958
Smiles:
CN1CCN(CC1)C1=Nc2ccccc2Nc2c1cccc2
Complexity:
413
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: __
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Smiles: OC[C@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2C=C[C@]23[C@@]1(C)C[C@H](O)[C@@]1([C@H]3CC(CC1)(C)C)CO2)C)C
Complexity: __
Covalently-bondedUnitCount: __
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Smiles:
OC[C@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2C=C[C@]23[C@@]1(C)C[C@H](O)[C@@]1([C@H]3CC(CC1)(C)C)CO2)C)C
Complexity:
__
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__
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__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
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__
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Smiles: COP(=S)(/N=C/1\OCCS1)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COP(=S)(/N=C/1\OCCS1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__