rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid
TL;DR: rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid (CAS 1608758-53-7) is a chemical compound with molecular formula C18H15FN2O3 and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid
Also Known As: (4-FLUOROBENZOYL)-D-TRYPTOPHAN, BAS 00557576, rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid, (2R)-2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid, (2S)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoic acid
| Molecular Formula | C18H15FN2O3 |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 2.7327 |
| Topological Polar Surface Area | 82.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.10666 |
| Heavy Atoms | 24 |
| Complexity | 886.6751 |
Chemical Identifiers
| CAS Number | 1608758-53-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)NC(=O)C3=CC=C(C=C3)F |
Product Overview
rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid (CAS 1608758-53-7), with molecular formula C18H15FN2O3 and molecular weight 326.11 g/mol. IUPAC: (2R)-2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid.
Chemical Property Profile of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid
Property Insights of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid
The XLogP value of 2.7327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid. The TPSA of 82.19 Ų falls within the moderate polarity range, balancing permeability and solubility for rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid. Following Lipinski's Rule of Five, rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid?
The CAS number of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid is 1608758-53-7.
What is the molecular formula of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid?
The molecular formula of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid is C18H15FN2O3.
What is the molecular weight of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid?
The molecular weight of rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid is 326.11 g/mol.
Where can I buy rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid?
You can request a quote for rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid?
Yes, KEHONG BIO provides custom synthesis services for rel-(2R)-2-[(4-fluorophenyl)formamido]-3-(1H-indol-3-yl)propanoicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.