6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester
TL;DR: 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester (CAS 65907-46-2) is a chemical compound with molecular formula C16H24N2O4S and molecular weight 340.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-propan-2-ylphenyl) N-methyl-N-[methyl(propan-2-yloxycarbonyl)amino]sulfanylcarbamate
Also Known As: 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester, 2,4,7-Trimethyl-5-oxo-6-oxa-3-thia-2,4-diazaoctanoic acid 3-(1-methyethyl)phenyl ester, Propan-2-yl 3-(propan-2-yl)phenyl sulfanediylbis(methylcarbamate), (3-propan-2-ylphenyl) N-methyl-N-[methyl(propan-2-yloxycarbonyl)amino]sulfanylcarbamate, BRN 2174283
| Molecular Formula | C16H24N2O4S |
|---|---|
| Molecular Weight | 340.15 g/mol |
| LogP | 4.2806 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.1457 |
| Heavy Atoms | 23 |
| Complexity | 548.6367 |
Chemical Identifiers
| CAS Number | 65907-46-2 |
|---|---|
| SMILES | CC(C)C1=CC(=CC=C1)OC(=O)N(C)SN(C)C(=O)OC(C)C |
Product Overview
6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester (CAS 65907-46-2), with molecular formula C16H24N2O4S and molecular weight 340.15 g/mol. IUPAC: (3-propan-2-ylphenyl) N-methyl-N-[methyl(propan-2-yloxycarbonyl)amino]sulfanylcarbamate.
Chemical Property Profile of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester
Property Insights of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester
The XLogP value of 4.2806 indicates that 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.08 Ų, 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester has 0 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 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester?
The CAS number of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester is 65907-46-2.
What is the molecular formula of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester?
The molecular formula of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester is C16H24N2O4S.
What is the molecular weight of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester?
The molecular weight of 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester is 340.15 g/mol.
Where can I buy 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester?
You can request a quote for 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 6-Oxa-3-thia-2,4-diazaoctanoic acid, 2,4,7-trimethyl-5-oxo-, 3-(1-methylethyl)phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.