AH88957
90729-42-3 | Carebastine
Manufacturer: A2B Chem
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CatalogNumber
AH88957
ChemicalName
Carebastine
CasNumber
90729-42-3
MolecularFormula
C32H37NO4
MolecularWeight
499.6405
MdlNumber
MFCD00865665
Smiles
OC(=O)C(c1ccc(cc1)C(=O)CCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1)(C)C
Complexity
690
Covalently-bondedUnitCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
11
Xlogp3
3.6
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CatalogNumber: AH88957
ChemicalName: Carebastine
CasNumber: 90729-42-3
MolecularFormula: C32H37NO4
MolecularWeight: 499.6405
MdlNumber: MFCD00865665
Smiles: OC(=O)C(c1ccc(cc1)C(=O)CCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1)(C)C
Complexity: 690
Covalently-bondedUnitCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 11
Xlogp3: 3.6
CatalogNumber:
AH88957
ChemicalName:
Carebastine
CasNumber:
90729-42-3
MolecularFormula:
C32H37NO4
MolecularWeight:
499.6405
MdlNumber:
MFCD00865665
Smiles:
OC(=O)C(c1ccc(cc1)C(=O)CCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1)(C)C
Complexity:
690
Covalently-bondedUnitCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
11
Xlogp3:
3.6
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Smiles: CCN(C(=O)OC(C)(C)C)C1CNC1
Complexity: __
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HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
CCN(C(=O)OC(C)(C)C)C1CNC1
Complexity:
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Smiles: Fc1ccccc1C(=O)c1ccc(cc1)CN1CCC2(CC1)OCCO2
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Smiles:
Fc1ccccc1C(=O)c1ccc(cc1)CN1CCC2(CC1)OCCO2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(cc1)C(=O)c1ccc(cc1)CN1CCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)C(=O)c1ccc(cc1)CN1CCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__