AI40386
1820639-05-1 | 1-Benzoyl-3-(2-hydroxy-5-nitrophenyl)urea
Manufacturer: A2B Chem
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CatalogNumber
AI40386
ChemicalName
1-Benzoyl-3-(2-hydroxy-5-nitrophenyl)urea
CasNumber
1820639-05-1
MolecularFormula
C14H11N3O5
MolecularWeight
301.2542
MdlNumber
MFCD27981309
Smiles
O=C(Nc1cc(ccc1O)[N+](=O)[O-])NC(=O)c1ccccc1
Complexity
431
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AI40386
ChemicalName: 1-Benzoyl-3-(2-hydroxy-5-nitrophenyl)urea
CasNumber: 1820639-05-1
MolecularFormula: C14H11N3O5
MolecularWeight: 301.2542
MdlNumber: MFCD27981309
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])NC(=O)c1ccccc1
Complexity: 431
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AI40386
ChemicalName:
1-Benzoyl-3-(2-hydroxy-5-nitrophenyl)urea
CasNumber:
1820639-05-1
MolecularFormula:
C14H11N3O5
MolecularWeight:
301.2542
MdlNumber:
MFCD27981309
Smiles:
O=C(Nc1cc(ccc1O)[N+](=O)[O-])NC(=O)c1ccccc1
Complexity:
431
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(c(c1O)N)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
CCOC(=O)c1cnc(c(c1O)N)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cnc(c(c1)[N+](=O)[O-])N1CCCC1
Complexity: 325
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1cnc(c(c1)[N+](=O)[O-])N1CCCC1
Complexity:
325
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
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MolecularFormula: __
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MdlNumber: __
Smiles: COc1c(Br)cccc1C(=O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(Br)cccc1C(=O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__