AI56706
815612-78-3 | 1-Benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea
Manufacturer: A2B Chem
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CatalogNumber
AI56706
ChemicalName
1-Benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea
CasNumber
815612-78-3
MolecularFormula
C14H11ClN2O2S
MolecularWeight
306.76733999999993
MdlNumber
MFCD05877780
Smiles
S=C(Nc1cc(Cl)ccc1O)NC(=O)c1ccccc1
Complexity
361
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AI56706
ChemicalName: 1-Benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea
CasNumber: 815612-78-3
MolecularFormula: C14H11ClN2O2S
MolecularWeight: 306.76733999999993
MdlNumber: MFCD05877780
Smiles: S=C(Nc1cc(Cl)ccc1O)NC(=O)c1ccccc1
Complexity: 361
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AI56706
ChemicalName:
1-Benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea
CasNumber:
815612-78-3
MolecularFormula:
C14H11ClN2O2S
MolecularWeight:
306.76733999999993
MdlNumber:
MFCD05877780
Smiles:
S=C(Nc1cc(Cl)ccc1O)NC(=O)c1ccccc1
Complexity:
361
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCc1ncsc1C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCc1ncsc1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc([N+](=O)[O-])c(cc1OC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc([N+](=O)[O-])c(cc1OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI56709
ChemicalName: 1-(3-Fluorophenyl)-2,2,2-trifluoroethanol
CasNumber: 81577-10-8
MolecularFormula: C8H6F4O
MolecularWeight: 194.1263
MdlNumber: MFCD16067876
Smiles: Fc1cccc(c1)C(C(F)(F)F)O
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AI56709
ChemicalName:
1-(3-Fluorophenyl)-2,2,2-trifluoroethanol
CasNumber:
81577-10-8
MolecularFormula:
C8H6F4O
MolecularWeight:
194.1263
MdlNumber:
MFCD16067876
Smiles:
Fc1cccc(c1)C(C(F)(F)F)O
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3