6-(Difluoromethyl)tryptophan
TL;DR: 6-(Difluoromethyl)tryptophan (CAS 131490-35-2) is a chemical compound with molecular formula C12H12F2N2O2 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[6-(difluoromethyl)-1H-indol-3-yl]propanoic acid
Also Known As: 6-(Difluoromethyl)tryptophan, 6-DF-Trp, n-octylbenzenesulfonate, 6-(Difluoromethyl)-L-tryptophan, L-Tryptophan,6-(difluoromethyl)-
| Molecular Formula | C12H12F2N2O2 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.08669 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 131490-35-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(F)F)NC=C2C[C@@H](C(=O)O)N |
| InChIKey | QKEFAXHAMIYOLM-VIFPVBQESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(Difluoromethyl)tryptophan (CAS 131490-35-2), with molecular formula C12H12F2N2O2 and molecular weight 254.09 g/mol. IUPAC: (2S)-2-amino-3-[6-(difluoromethyl)-1H-indol-3-yl]propanoic acid.
Chemical Property Profile of 6-(Difluoromethyl)tryptophan
Property Insights of 6-(Difluoromethyl)tryptophan
The XLogP value of -0.4 indicates that 6-(Difluoromethyl)tryptophan is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Difluoromethyl)tryptophan. Following Lipinski's Rule of Five, 6-(Difluoromethyl)tryptophan has 3 hydrogen bond donor(s) and 5 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 6-(Difluoromethyl)tryptophan?
The CAS number of 6-(Difluoromethyl)tryptophan is 131490-35-2.
What is the molecular formula of 6-(Difluoromethyl)tryptophan?
The molecular formula of 6-(Difluoromethyl)tryptophan is C12H12F2N2O2.
What is the molecular weight of 6-(Difluoromethyl)tryptophan?
The molecular weight of 6-(Difluoromethyl)tryptophan is 254.09 g/mol.
Where can I buy 6-(Difluoromethyl)tryptophan?
You can request a quote for 6-(Difluoromethyl)tryptophan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Difluoromethyl)tryptophan?
Yes, KEHONG BIO provides custom synthesis services for 6-(Difluoromethyl)tryptophan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.