10H-914
TL;DR: 10H-914 (CAS 337920-12-4) is a chemical compound with molecular formula C17H14ClF3N4O5 and molecular weight 446.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]methyl]-4,5-dihydro-1,2-oxazole-3-carbonyl]-1,2-oxazole-3-carboxylate
Also Known As: 10H-914, ethyl 4-{[5-({[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}methyl)-4,5-dihydro-3-isoxazolyl]carbonyl}-3-isoxazolecarboxylate, ethyl 4-[5-[[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]methyl]-4,5-dihydro-1,2-oxazole-3-carbonyl]-1,2-oxazole-3-carboxylate, ethyl 4-[5-({[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}methyl)-4,5-dihydro-1,2-oxazole-3-carbonyl]-1,2-oxazole-3-carboxylate, ethyl4-[5-({[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}methyl)-4,5-dihydro-1,2-oxazole-3-carbonyl]-1,2-oxazole-3-carboxylate
| Molecular Formula | C17H14ClF3N4O5 |
|---|---|
| Molecular Weight | 446.06 g/mol |
| LogP | 3.3582 |
| Topological Polar Surface Area | 115.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.0605 |
| Heavy Atoms | 30 |
| Complexity | 992.01355 |
Chemical Identifiers
| CAS Number | 337920-12-4 |
|---|---|
| SMILES | CCOC(=O)C1=NOC=C1C(=O)C2=NOC(C2)CNC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
10H-914 (CAS 337920-12-4), with molecular formula C17H14ClF3N4O5 and molecular weight 446.06 g/mol. IUPAC: ethyl 4-[5-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]methyl]-4,5-dihydro-1,2-oxazole-3-carbonyl]-1,2-oxazole-3-carboxylate.
Chemical Property Profile of 10H-914
Property Insights of 10H-914
The XLogP value of 3.3582 indicates that 10H-914 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 10H-914. Following Lipinski's Rule of Five, 10H-914 has 1 hydrogen bond donor(s) and 9 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 10H-914?
The CAS number of 10H-914 is 337920-12-4.
What is the molecular formula of 10H-914?
The molecular formula of 10H-914 is C17H14ClF3N4O5.
What is the molecular weight of 10H-914?
The molecular weight of 10H-914 is 446.06 g/mol.
Where can I buy 10H-914?
You can request a quote for 10H-914 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10H-914?
Yes, KEHONG BIO provides custom synthesis services for 10H-914 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.