RefChem:1074113
TL;DR: RefChem:1074113 (CAS 65907-51-9) is a chemical compound with molecular formula C10H19N3O4S2 and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1E)-N-[methyl-[methyl(propan-2-yloxycarbonyl)amino]sulfanylcarbamoyl]oxyethanimidothioate
Also Known As: 6-Oxa-3,9-dithia-2,4,7-triazadec-7-enoic acid, 2,4,8-trimethyl-5-oxo-, 1-methylethyl ester, 2,4,8-Trimethyl-5-oxo-6-oxa-3,9-dithia-2,4,7-triazadec-7-enoic acid 1-methylethyl ester, RefChem:1074113, BRN 2142638
| Molecular Formula | C10H19N3O4S2 |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 2.7912 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.0817 |
| Heavy Atoms | 19 |
| Complexity | 349.66647 |
Chemical Identifiers
| CAS Number | 65907-51-9 |
|---|---|
| SMILES | CC(C)OC(=O)N(C)SN(C)C(=O)O/N=C(\C)/SC |
Product Overview
RefChem:1074113 (CAS 65907-51-9), with molecular formula C10H19N3O4S2 and molecular weight 309.08 g/mol. IUPAC: methyl (1E)-N-[methyl-[methyl(propan-2-yloxycarbonyl)amino]sulfanylcarbamoyl]oxyethanimidothioate.
Chemical Property Profile of RefChem:1074113
Property Insights of RefChem:1074113
The XLogP value of 2.7912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1074113. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1074113. Following Lipinski's Rule of Five, RefChem:1074113 has 0 hydrogen bond donor(s) and 7 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 RefChem:1074113?
The CAS number of RefChem:1074113 is 65907-51-9.
What is the molecular formula of RefChem:1074113?
The molecular formula of RefChem:1074113 is C10H19N3O4S2.
What is the molecular weight of RefChem:1074113?
The molecular weight of RefChem:1074113 is 309.08 g/mol.
Where can I buy RefChem:1074113?
You can request a quote for RefChem:1074113 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1074113?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1074113 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.