AF87740
365426-93-3 | 3-(4-Trifluoromethylphenyl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AF87740
ChemicalName
3-(4-Trifluoromethylphenyl)phenol
CasNumber
365426-93-3
MolecularFormula
C13H9F3O
MolecularWeight
238.2052
MdlNumber
MFCD06802315
Smiles
Oc1cccc(c1)c1ccc(cc1)C(F)(F)F
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
4.1
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CatalogNumber: AF87740
ChemicalName: 3-(4-Trifluoromethylphenyl)phenol
CasNumber: 365426-93-3
MolecularFormula: C13H9F3O
MolecularWeight: 238.2052
MdlNumber: MFCD06802315
Smiles: Oc1cccc(c1)c1ccc(cc1)C(F)(F)F
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 4.1
CatalogNumber:
AF87740
ChemicalName:
3-(4-Trifluoromethylphenyl)phenol
CasNumber:
365426-93-3
MolecularFormula:
C13H9F3O
MolecularWeight:
238.2052
MdlNumber:
MFCD06802315
Smiles:
Oc1cccc(c1)c1ccc(cc1)C(F)(F)F
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
4.1
CatalogNumber: AF87741
ChemicalName: 2,4-Dihydroxypyrido[3,2-d]pyrimidine
CasNumber: 37538-68-4
MolecularFormula: C7H5N3O2
MolecularWeight: 163.1335
MdlNumber: MFCD13185173
Smiles: O=c1[nH]c2cccnc2c(=O)[nH]1
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: -0.3
CatalogNumber:
AF87741
ChemicalName:
2,4-Dihydroxypyrido[3,2-d]pyrimidine
CasNumber:
37538-68-4
MolecularFormula:
C7H5N3O2
MolecularWeight:
163.1335
MdlNumber:
MFCD13185173
Smiles:
O=c1[nH]c2cccnc2c(=O)[nH]1
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
-0.3
CatalogNumber: AF87742
ChemicalName: 1-Bromo-4-(4-methylpiperazinocarbonylmethyl)benzene
CasNumber: 349430-56-4
MolecularFormula: C13H17BrN2O
MolecularWeight: 297.1909
MdlNumber: MFCD02860726
Smiles: CN1CCN(CC1)C(=O)Cc1ccc(cc1)Br
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AF87742
ChemicalName:
1-Bromo-4-(4-methylpiperazinocarbonylmethyl)benzene
CasNumber:
349430-56-4
MolecularFormula:
C13H17BrN2O
MolecularWeight:
297.1909
MdlNumber:
MFCD02860726
Smiles:
CN1CCN(CC1)C(=O)Cc1ccc(cc1)Br
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AF87743
ChemicalName: 4-Chloro-3-(morpholine-4-sulfonyl)-phenylamine
CasNumber: 325724-68-3
MolecularFormula: C10H13ClN2O3S
MolecularWeight: 276.7398
MdlNumber: MFCD02696242
Smiles: Clc1ccc(cc1S(=O)(=O)N1CCOCC1)N
Complexity: 351
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AF87743
ChemicalName:
4-Chloro-3-(morpholine-4-sulfonyl)-phenylamine
CasNumber:
325724-68-3
MolecularFormula:
C10H13ClN2O3S
MolecularWeight:
276.7398
MdlNumber:
MFCD02696242
Smiles:
Clc1ccc(cc1S(=O)(=O)N1CCOCC1)N
Complexity:
351
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.6