2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide
TL;DR: 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide (CAS 371949-76-7) is a chemical compound with molecular formula C17H21N5O3S and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl]-3-oxo-N-phenylbutanamide
Also Known As: 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide, 2-((4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl)thio)-3-oxo-N-phenylbutanamide, 2-[[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl]-3-oxo-N-phenylbutanamide
| Molecular Formula | C17H21N5O3S |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.1365 |
| Heavy Atoms | 26 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 371949-76-7 |
|---|---|
| SMILES | CCOC1=NC(=NC(=N1)N(C)C)SC(C(=O)C)C(=O)NC2=CC=CC=C2 |
| InChIKey | AXPZNPSZLZQBBR-UHFFFAOYSA-N |
Product Overview
2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide (CAS 371949-76-7), with molecular formula C17H21N5O3S and molecular weight 375.14 g/mol. IUPAC: 2-[[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl]-3-oxo-N-phenylbutanamide.
Chemical Property Profile of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide
Property Insights of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide
The XLogP value of 3.4 indicates that 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide. Following Lipinski's Rule of Five, 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide 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 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide?
The CAS number of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide is 371949-76-7.
What is the molecular formula of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide?
The molecular formula of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide is C17H21N5O3S.
What is the molecular weight of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide?
The molecular weight of 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide is 375.14 g/mol.
Where can I buy 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide?
You can request a quote for 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(dimethylamino)-6-ethoxy-1,3,5-triazin-2-yl]sulfanyl}-3-oxo-N-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.