AA57032
1381944-37-1 | Methyl 3-[(4-Cbz-amino)phenyl]-2-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA57032
ChemicalName
Methyl 3-[(4-Cbz-amino)phenyl]-2-fluorobenzoate
CasNumber
1381944-37-1
MolecularFormula
C22H18FNO4
MolecularWeight
379.381
MdlNumber
MFCD22375049
Smiles
COC(=O)c1cccc(c1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity
515
Covalently-bondedUnitCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
4.6
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CatalogNumber: AA57032
ChemicalName: Methyl 3-[(4-Cbz-amino)phenyl]-2-fluorobenzoate
CasNumber: 1381944-37-1
MolecularFormula: C22H18FNO4
MolecularWeight: 379.381
MdlNumber: MFCD22375049
Smiles: COC(=O)c1cccc(c1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity: 515
Covalently-bondedUnitCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 4.6
CatalogNumber:
AA57032
ChemicalName:
Methyl 3-[(4-Cbz-amino)phenyl]-2-fluorobenzoate
CasNumber:
1381944-37-1
MolecularFormula:
C22H18FNO4
MolecularWeight:
379.381
MdlNumber:
MFCD22375049
Smiles:
COC(=O)c1cccc(c1F)c1ccc(cc1)NC(=O)OCc1ccccc1
Complexity:
515
Covalently-bondedUnitCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
4.6
CatalogNumber: AA57033
ChemicalName: Methyl 4-fluoro-3-(4-methoxyphenyl)benzoate
CasNumber: 1381944-35-9
MolecularFormula: C15H13FO3
MolecularWeight: 260.2603
MdlNumber: MFCD22375075
Smiles: COc1ccc(cc1)c1cc(ccc1F)C(=O)OC
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 3.5
CatalogNumber:
AA57033
ChemicalName:
Methyl 4-fluoro-3-(4-methoxyphenyl)benzoate
CasNumber:
1381944-35-9
MolecularFormula:
C15H13FO3
MolecularWeight:
260.2603
MdlNumber:
MFCD22375075
Smiles:
COc1ccc(cc1)c1cc(ccc1F)C(=O)OC
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
3.5
CatalogNumber: AA57034
ChemicalName: Methyl 3-[4-(dimethylcarbamoyl)phenyl]-2-fluorobenzoate
CasNumber: 1381944-34-8
MolecularFormula: C17H16FNO3
MolecularWeight: 301.3122
MdlNumber: MFCD22375050
Smiles: COC(=O)c1cccc(c1F)c1ccc(cc1)C(=O)N(C)C
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AA57034
ChemicalName:
Methyl 3-[4-(dimethylcarbamoyl)phenyl]-2-fluorobenzoate
CasNumber:
1381944-34-8
MolecularFormula:
C17H16FNO3
MolecularWeight:
301.3122
MdlNumber:
MFCD22375050
Smiles:
COC(=O)c1cccc(c1F)c1ccc(cc1)C(=O)N(C)C
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: AA57035
ChemicalName: 4-[3-(Benzyloxy)phenyl]-2-fluorobenzonitrile
CasNumber: 1381944-33-7
MolecularFormula: C20H14FNO
MolecularWeight: 303.3297
MdlNumber: MFCD22375061
Smiles: N#Cc1ccc(cc1F)c1cccc(c1)OCc1ccccc1
Complexity: 411
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 4.8
CatalogNumber:
AA57035
ChemicalName:
4-[3-(Benzyloxy)phenyl]-2-fluorobenzonitrile
CasNumber:
1381944-33-7
MolecularFormula:
C20H14FNO
MolecularWeight:
303.3297
MdlNumber:
MFCD22375061
Smiles:
N#Cc1ccc(cc1F)c1cccc(c1)OCc1ccccc1
Complexity:
411
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
4.8