10H-955
TL;DR: 10H-955 (CAS 337920-37-3) is a chemical compound with molecular formula C19H13ClF3N5O3 and molecular weight 451.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile
Also Known As: 10H-955, 4-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile, 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile, 4-[(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)amino]-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile, 4-[(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)amino]-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile
| Molecular Formula | C19H13ClF3N5O3 |
|---|---|
| Molecular Weight | 451.07 g/mol |
| LogP | 4.57558 |
| Topological Polar Surface Area | 104.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.0659 |
| Heavy Atoms | 31 |
| Complexity | 1204.381 |
Chemical Identifiers
| CAS Number | 337920-37-3 |
|---|---|
| SMILES | CN(C)C1=NC(=C(C(=O)O1)C#N)NC2=CC=C(C=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
10H-955 (CAS 337920-37-3), with molecular formula C19H13ClF3N5O3 and molecular weight 451.07 g/mol. IUPAC: 4-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile.
Chemical Property Profile of 10H-955
Property Insights of 10H-955
The XLogP value of 4.57558 indicates that 10H-955 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 10H-955. Following Lipinski's Rule of Five, 10H-955 has 1 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 10H-955?
The CAS number of 10H-955 is 337920-37-3.
What is the molecular formula of 10H-955?
The molecular formula of 10H-955 is C19H13ClF3N5O3.
What is the molecular weight of 10H-955?
The molecular weight of 10H-955 is 451.07 g/mol.
Where can I buy 10H-955?
You can request a quote for 10H-955 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10H-955?
Yes, KEHONG BIO provides custom synthesis services for 10H-955 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.