AD69465
150915-40-5 | Tirofiban HCl monohydrate
Manufacturer: A2B Chem
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CatalogNumber
AD69465
ChemicalName
Tirofiban HCl monohydrate
CasNumber
150915-40-5
MolecularFormula
C22H39ClN2O6S
MolecularWeight
495.0729
MdlNumber
MFCD00868210
Smiles
CCCCS(=O)(=O)N[C@H](C(=O)O)Cc1ccc(cc1)OCCCCC1CCNCC1.Cl.O
Complexity
579
Covalently-bondedUnitCount
3
DefinedAtomStereocenterCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
5
RotatableBondCount
14
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CatalogNumber: AD69465
ChemicalName: Tirofiban HCl monohydrate
CasNumber: 150915-40-5
MolecularFormula: C22H39ClN2O6S
MolecularWeight: 495.0729
MdlNumber: MFCD00868210
Smiles: CCCCS(=O)(=O)N[C@H](C(=O)O)Cc1ccc(cc1)OCCCCC1CCNCC1.Cl.O
Complexity: 579
Covalently-bondedUnitCount: 3
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 5
RotatableBondCount: 14
CatalogNumber:
AD69465
ChemicalName:
Tirofiban HCl monohydrate
CasNumber:
150915-40-5
MolecularFormula:
C22H39ClN2O6S
MolecularWeight:
495.0729
MdlNumber:
MFCD00868210
Smiles:
CCCCS(=O)(=O)N[C@H](C(=O)O)Cc1ccc(cc1)OCCCCC1CCNCC1.Cl.O
Complexity:
579
Covalently-bondedUnitCount:
3
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
5
RotatableBondCount:
14
CatalogNumber: __
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Smiles: O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1.Cl
Complexity: __
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Smiles:
O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1.Cl
Complexity:
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Smiles: O=C(N1CCC21CCNC2=O)OC(C)(C)C
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ChemicalName:
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CasNumber:
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MdlNumber:
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Smiles:
O=C(N1CCC21CCNC2=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(Cc1ccncc1)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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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:
CC(Cc1ccncc1)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__