AA59376
138977-28-3 | Capsazepine
Manufacturer: A2B Chem
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CatalogNumber
AA59376
ChemicalName
Capsazepine
CasNumber
138977-28-3
MolecularFormula
C19H21ClN2O2S
MolecularWeight
376.9002
MdlNumber
MFCD00153778
Smiles
Clc1ccc(cc1)CCNC(=S)N1CCCc2c(C1)cc(O)c(c2)O
Complexity
445
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
3
Xlogp3
3.9
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CatalogNumber: AA59376
ChemicalName: Capsazepine
CasNumber: 138977-28-3
MolecularFormula: C19H21ClN2O2S
MolecularWeight: 376.9002
MdlNumber: MFCD00153778
Smiles: Clc1ccc(cc1)CCNC(=S)N1CCCc2c(C1)cc(O)c(c2)O
Complexity: 445
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AA59376
ChemicalName:
Capsazepine
CasNumber:
138977-28-3
MolecularFormula:
C19H21ClN2O2S
MolecularWeight:
376.9002
MdlNumber:
MFCD00153778
Smiles:
Clc1ccc(cc1)CCNC(=S)N1CCCc2c(C1)cc(O)c(c2)O
Complexity:
445
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNc1ccc2c(c1)CCN=C2C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
CNc1ccc2c(c1)CCN=C2C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: Cl[C@@H]1CCCC[C@H]1Br
Complexity: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cl[C@@H]1CCCC[C@H]1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: O[Cl]=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[Cl]=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__