CAS 476465-11-9 - C16H15N3O5S2
TL;DR: CAS 476465-11-9 - C16H15N3O5S2 (CAS 476465-11-9) is a chemical compound with molecular formula C16H15N3O5S2 and molecular weight 393.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
Also Known As: ethyl 2-({5-[(2Z)-3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate
| Molecular Formula | C16H15N3O5S2 |
|---|---|
| Molecular Weight | 393.05 g/mol |
| LogP | 2.5739 |
| Topological Polar Surface Area | 99.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.04532 |
| Heavy Atoms | 26 |
| Complexity | 837.0427 |
Chemical Identifiers
| CAS Number | 476465-11-9 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(S1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3 |
Product Overview
CAS 476465-11-9 - C16H15N3O5S2 (CAS 476465-11-9), with molecular formula C16H15N3O5S2 and molecular weight 393.05 g/mol. IUPAC: ethyl 2-[[5-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of CAS 476465-11-9 - C16H15N3O5S2
Property Insights of CAS 476465-11-9 - C16H15N3O5S2
The XLogP value of 2.5739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 476465-11-9 - C16H15N3O5S2. The TPSA of 99.64 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 476465-11-9 - C16H15N3O5S2. Following Lipinski's Rule of Five, CAS 476465-11-9 - C16H15N3O5S2 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 CAS 476465-11-9 - C16H15N3O5S2?
The CAS number of CAS 476465-11-9 - C16H15N3O5S2 is 476465-11-9.
What is the molecular formula of CAS 476465-11-9 - C16H15N3O5S2?
The molecular formula of CAS 476465-11-9 - C16H15N3O5S2 is C16H15N3O5S2.
What is the molecular weight of CAS 476465-11-9 - C16H15N3O5S2?
The molecular weight of CAS 476465-11-9 - C16H15N3O5S2 is 393.05 g/mol.
Where can I buy CAS 476465-11-9 - C16H15N3O5S2?
You can request a quote for CAS 476465-11-9 - C16H15N3O5S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 476465-11-9 - C16H15N3O5S2?
Yes, KEHONG BIO provides custom synthesis services for CAS 476465-11-9 - C16H15N3O5S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.