11H-918
TL;DR: 11H-918 (CAS 303152-96-7) is a chemical compound with molecular formula C14H11ClF3N5O and molecular weight 357.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-6-methyl-4-oxopyrimidine-5-carbonitrile
Also Known As: 11H-918, 1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-6-methyl-4-oxopyrimidine-5-carbonitrile, 1-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-6-methyl-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile, 1-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)-6-methyl-4-oxo-1,4-dihydropyrimidine-5-carbonitrile
| Molecular Formula | C14H11ClF3N5O |
|---|---|
| Molecular Weight | 357.06 g/mol |
| LogP | 2.6027 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.06042 |
| Heavy Atoms | 24 |
| Complexity | 856.9542 |
Chemical Identifiers
| CAS Number | 303152-96-7 |
|---|---|
| SMILES | CC1=C(C(=O)N=CN1CCNC2=C(C=C(C=N2)C(F)(F)F)Cl)C#N |
Product Overview
11H-918 (CAS 303152-96-7), with molecular formula C14H11ClF3N5O and molecular weight 357.06 g/mol. IUPAC: 1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-6-methyl-4-oxopyrimidine-5-carbonitrile.
Chemical Property Profile of 11H-918
Property Insights of 11H-918
The XLogP value of 2.6027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11H-918. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 11H-918. Following Lipinski's Rule of Five, 11H-918 has 1 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 11H-918?
The CAS number of 11H-918 is 303152-96-7.
What is the molecular formula of 11H-918?
The molecular formula of 11H-918 is C14H11ClF3N5O.
What is the molecular weight of 11H-918?
The molecular weight of 11H-918 is 357.06 g/mol.
Where can I buy 11H-918?
You can request a quote for 11H-918 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11H-918?
Yes, KEHONG BIO provides custom synthesis services for 11H-918 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.