AA56226
1226056-71-8 | Thiazovivin
Manufacturer: A2B Chem
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CatalogNumber
AA56226
ChemicalName
Thiazovivin
CasNumber
1226056-71-8
MolecularFormula
C15H13N5OS
MolecularWeight
311.3616
MdlNumber
MFCD16495823
Smiles
O=C(c1csc(n1)Nc1ccncn1)NCc1ccccc1
Complexity
364
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
2.5
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CatalogNumber: AA56226
ChemicalName: Thiazovivin
CasNumber: 1226056-71-8
MolecularFormula: C15H13N5OS
MolecularWeight: 311.3616
MdlNumber: MFCD16495823
Smiles: O=C(c1csc(n1)Nc1ccncn1)NCc1ccccc1
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AA56226
ChemicalName:
Thiazovivin
CasNumber:
1226056-71-8
MolecularFormula:
C15H13N5OS
MolecularWeight:
311.3616
MdlNumber:
MFCD16495823
Smiles:
O=C(c1csc(n1)Nc1ccncn1)NCc1ccccc1
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
2.5
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Smiles: [N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)C(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
[N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)C(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: CCCCCCCCCCCOC[C@H]1CO1
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Smiles:
CCCCCCCCCCCOC[C@H]1CO1
Complexity:
__
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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Smiles: CC(C(=O)OCC1COC(=O)O1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CC(C(=O)OCC1COC(=O)O1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__