D051-0006
TL;DR: D051-0006 (CAS 838899-23-3) is a chemical compound with molecular formula C18H21NO4S2 and molecular weight 379.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-4-methoxy-N-[(3-methylthiophen-2-yl)methyl]benzamide
Also Known As: D051-0006, N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methoxy-N-[(3-methylthiophen-2-yl)methyl]benzamide, N-(1,1-dioxothiolan-3-yl)-4-methoxy-N-[(3-methylthiophen-2-yl)methyl]benzamide, N-(11-DIOXO-1LAMBDA6-THIOLAN-3-YL)-4-METHOXY-N-[(3-METHYLTHIOPHEN-2-YL)METHYL]BENZAMIDE
| Molecular Formula | C18H21NO4S2 |
|---|---|
| Molecular Weight | 379.09 g/mol |
| LogP | 2.89462 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.0912 |
| Heavy Atoms | 25 |
| Complexity | 855.4562 |
Chemical Identifiers
| CAS Number | 838899-23-3 |
|---|---|
| SMILES | CC1=C(SC=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)OC |
Product Overview
D051-0006 (CAS 838899-23-3), with molecular formula C18H21NO4S2 and molecular weight 379.09 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-4-methoxy-N-[(3-methylthiophen-2-yl)methyl]benzamide.
Chemical Property Profile of D051-0006
Property Insights of D051-0006
The XLogP value of 2.89462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for D051-0006. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for D051-0006. Following Lipinski's Rule of Five, D051-0006 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 D051-0006?
The CAS number of D051-0006 is 838899-23-3.
What is the molecular formula of D051-0006?
The molecular formula of D051-0006 is C18H21NO4S2.
What is the molecular weight of D051-0006?
The molecular weight of D051-0006 is 379.09 g/mol.
Where can I buy D051-0006?
You can request a quote for D051-0006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D051-0006?
Yes, KEHONG BIO provides custom synthesis services for D051-0006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.