10L-949
TL;DR: 10L-949 (CAS 321385-52-8) is a chemical compound with molecular formula C20H18ClF3N4O5 and molecular weight 486.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 10-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.02,6.08,12]tridec-4-ene-5-carboxylate
Also Known As: 10L-949, ethyl 10-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.0~2,6~.0~8,12~]tridec-4-ene-5-carboxylate, ethyl 10-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.02,6.08,12]tridec-4-ene-5-carboxylate, ethyl 10-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.0^{2,6}.0^{8,12}]tridec-4-ene-5-carboxylate, ethyl10-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.0^{2,6}.0^{8,12}]tridec-4-ene-5-carboxylate
| Molecular Formula | C20H18ClF3N4O5 |
|---|---|
| Molecular Weight | 486.09 g/mol |
| LogP | 2.29 |
| Topological Polar Surface Area | 101.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.0918 |
| Heavy Atoms | 33 |
| Complexity | 1095.9489 |
Chemical Identifiers
| CAS Number | 321385-52-8 |
|---|---|
| SMILES | CCOC(=O)C1=NOC2C1C3CC2C4C3C(=O)N(C4=O)N(C)C5=C(C=C(C=N5)C(F)(F)F)Cl |
Product Overview
10L-949 (CAS 321385-52-8), with molecular formula C20H18ClF3N4O5 and molecular weight 486.09 g/mol. IUPAC: ethyl 10-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-9,11-dioxo-3-oxa-4,10-diazatetracyclo[5.5.1.02,6.08,12]tridec-4-ene-5-carboxylate.
Chemical Property Profile of 10L-949
Property Insights of 10L-949
The XLogP value of 2.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10L-949. The TPSA of 101.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 10L-949. Following Lipinski's Rule of Five, 10L-949 has 0 hydrogen bond donor(s) and 8 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 10L-949?
The CAS number of 10L-949 is 321385-52-8.
What is the molecular formula of 10L-949?
The molecular formula of 10L-949 is C20H18ClF3N4O5.
What is the molecular weight of 10L-949?
The molecular weight of 10L-949 is 486.09 g/mol.
Where can I buy 10L-949?
You can request a quote for 10L-949 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10L-949?
Yes, KEHONG BIO provides custom synthesis services for 10L-949 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.