AA57097
1381944-75-7 | Benzyl N-[4-(4-cyano-3-fluorophenyl)phenyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AA57097
ChemicalName
Benzyl N-[4-(4-cyano-3-fluorophenyl)phenyl]carbamate
CasNumber
1381944-75-7
MolecularFormula
C21H15FN2O2
MolecularWeight
346.3544
MdlNumber
MFCD22375060
Smiles
N#Cc1ccc(cc1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity
503
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
4.4
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CatalogNumber: AA57097
ChemicalName: Benzyl N-[4-(4-cyano-3-fluorophenyl)phenyl]carbamate
CasNumber: 1381944-75-7
MolecularFormula: C21H15FN2O2
MolecularWeight: 346.3544
MdlNumber: MFCD22375060
Smiles: N#Cc1ccc(cc1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity: 503
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.4
CatalogNumber:
AA57097
ChemicalName:
Benzyl N-[4-(4-cyano-3-fluorophenyl)phenyl]carbamate
CasNumber:
1381944-75-7
MolecularFormula:
C21H15FN2O2
MolecularWeight:
346.3544
MdlNumber:
MFCD22375060
Smiles:
N#Cc1ccc(cc1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity:
503
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCn1c(C)nc2c1cc(F)c(c2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCn1c(C)nc2c1cc(F)c(c2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA57099
ChemicalName: 2-Methoxy-5-[4-(methylsulfanyl)phenyl]pyridine
CasNumber: 1381944-73-5
MolecularFormula: C13H13NOS
MolecularWeight: 231.3134
MdlNumber: MFCD22375066
Smiles: CSc1ccc(cc1)c1ccc(nc1)OC
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AA57099
ChemicalName:
2-Methoxy-5-[4-(methylsulfanyl)phenyl]pyridine
CasNumber:
1381944-73-5
MolecularFormula:
C13H13NOS
MolecularWeight:
231.3134
MdlNumber:
MFCD22375066
Smiles:
CSc1ccc(cc1)c1ccc(nc1)OC
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(ccc1F)c1cccc(c1F)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(ccc1F)c1cccc(c1F)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__