AI52552
55981-09-4 | 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate
Manufacturer: A2B Chem
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CatalogNumber
AI52552
ChemicalName
2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate
CasNumber
55981-09-4
MolecularFormula
C12H9N3O5S
MolecularWeight
307.28196
MdlNumber
MFCD00416599
Smiles
CC(=O)Oc1ccccc1C(=O)Nc1ncc(s1)[N+](=O)[O-]
Complexity
428
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2
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CatalogNumber: AI52552
ChemicalName: 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate
CasNumber: 55981-09-4
MolecularFormula: C12H9N3O5S
MolecularWeight: 307.28196
MdlNumber: MFCD00416599
Smiles: CC(=O)Oc1ccccc1C(=O)Nc1ncc(s1)[N+](=O)[O-]
Complexity: 428
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2
CatalogNumber:
AI52552
ChemicalName:
2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate
CasNumber:
55981-09-4
MolecularFormula:
C12H9N3O5S
MolecularWeight:
307.28196
MdlNumber:
MFCD00416599
Smiles:
CC(=O)Oc1ccccc1C(=O)Nc1ncc(s1)[N+](=O)[O-]
Complexity:
428
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2
CatalogNumber: __
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MolecularFormula: __
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Smiles: Clc1cccc2c1[nH]c1c2cccc1
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
Clc1cccc2c1[nH]c1c2cccc1
Complexity:
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Smiles: COc1nc(C)cc(n1)O
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Smiles:
COc1nc(C)cc(n1)O
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Nc1cc(=O)[nH]c(=N)[nH]1
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Smiles:
Nc1cc(=O)[nH]c(=N)[nH]1
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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