Molecule

ID:38841

General Information
Structure
MolImage
Molecular Formula
C₂₃H₁₉NO₄
Molecular Mass
373.40126
Exact Mass
373.13140809
Charge
0
InChI
InChI=1S/C23H19NO4/c1-24(16-12-10-15(11-13-16)22(25)26)23(27)28-14-21-19-8-4-2-6-17(19)18-7-3-5-9-20(18)21/h2-13,21H,14H2,1H3,(H,25,26)
InChIKey
HQOGMQFPENTFMI-UHFFFAOYSA-N
Canonic Smiles
O=C(N(c1ccc(cc1)C(=O)O)C)OCC1c2ccccc2c2c1cccc2
Isomeric Smiles
c1cc(ccc1N(C)C(=O)OCC1c2c(c3c1cccc3)cccc2)C(=O)O
Calculated Properties
JChem
Acid pKa
4.1029973
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
3.1269026
LogD (pH = 7.4)
1.4407333
Log P
4.537787
Molar Refractivity
105.9291
Polarizability
41.711693
Polar Surface Area
66.84
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
Navigation
CAS 160977-92-4|4-{[(9H-fluoren-9-ylmethoxy)carbonyl](methyl)amino}benzoic acid|4-{[(9H-fluoren-9-ylmethoxy)carbonyl](methyl)amino}benzoic acid|Fmoc-4-methylaminobenzoic acid|4-(N-Fmoc-甲氨基)苯甲酸... | Molfinder