NCI60_039764
TL;DR: NCI60_039764 (CAS 371929-03-2) is a chemical compound with molecular formula C17H26F3N3O4S and molecular weight 425.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[cyclohexyl-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)carbamoyl]amino]-3,3,3-trifluoro-2-methoxypropanoate
Also Known As: NCI60_039764, ethyl N-[cyclohexyl(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)carbamoyl]-3,3,3-trifluoro-2-methoxyalaninate, ethyl 2-(3-cyclohexyl-3-(5-methyl-4,5-dihydrothiazol-2-yl)ureido)-3,3,3-trifluoro-2-methoxypropanoate, ethyl 2-[[cyclohexyl-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)carbamoyl]amino]-3,3,3-trifluoro-2-methoxypropanoate
| Molecular Formula | C17H26F3N3O4S |
|---|---|
| Molecular Weight | 425.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.1596 |
| Heavy Atoms | 28 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 371929-03-2 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)N(C1CCCCC1)C2=NCC(S2)C)OC |
| InChIKey | RBVQLKSRTDJHBW-UHFFFAOYSA-N |
Product Overview
NCI60_039764 (CAS 371929-03-2), with molecular formula C17H26F3N3O4S and molecular weight 425.16 g/mol. IUPAC: ethyl 2-[[cyclohexyl-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)carbamoyl]amino]-3,3,3-trifluoro-2-methoxypropanoate.
Chemical Property Profile of NCI60_039764
Property Insights of NCI60_039764
The XLogP value of 3.4 indicates that NCI60_039764 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_039764. Following Lipinski's Rule of Five, NCI60_039764 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 NCI60_039764?
The CAS number of NCI60_039764 is 371929-03-2.
What is the molecular formula of NCI60_039764?
The molecular formula of NCI60_039764 is C17H26F3N3O4S.
What is the molecular weight of NCI60_039764?
The molecular weight of NCI60_039764 is 425.16 g/mol.
Where can I buy NCI60_039764?
You can request a quote for NCI60_039764 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_039764?
Yes, KEHONG BIO provides custom synthesis services for NCI60_039764 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.