CAS 476463-08-8 - C18H13N3O3S
TL;DR: CAS 476463-08-8 - C18H13N3O3S (CAS 476463-08-8) is a chemical compound with molecular formula C18H13N3O3S and molecular weight 351.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1,3-benzodioxol-5-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)prop-2-enamide
Also Known As: (2Z)-3-(2H-1,3-benzodioxol-5-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)prop-2-enamide
| Molecular Formula | C18H13N3O3S |
|---|---|
| Molecular Weight | 351.07 g/mol |
| LogP | 3.5857 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.06775 |
| Heavy Atoms | 25 |
| Complexity | 937.74915 |
Chemical Identifiers
| CAS Number | 476463-08-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)NC3=NN=C(S3)C4=CC=CC=C4 |
Product Overview
CAS 476463-08-8 - C18H13N3O3S (CAS 476463-08-8), with molecular formula C18H13N3O3S and molecular weight 351.07 g/mol. IUPAC: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)prop-2-enamide.
Chemical Property Profile of CAS 476463-08-8 - C18H13N3O3S
Property Insights of CAS 476463-08-8 - C18H13N3O3S
The XLogP value of 3.5857 indicates that CAS 476463-08-8 - C18H13N3O3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 476463-08-8 - C18H13N3O3S. Following Lipinski's Rule of Five, CAS 476463-08-8 - C18H13N3O3S has 1 hydrogen bond donor(s) and 6 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 476463-08-8 - C18H13N3O3S?
The CAS number of CAS 476463-08-8 - C18H13N3O3S is 476463-08-8.
What is the molecular formula of CAS 476463-08-8 - C18H13N3O3S?
The molecular formula of CAS 476463-08-8 - C18H13N3O3S is C18H13N3O3S.
What is the molecular weight of CAS 476463-08-8 - C18H13N3O3S?
The molecular weight of CAS 476463-08-8 - C18H13N3O3S is 351.07 g/mol.
Where can I buy CAS 476463-08-8 - C18H13N3O3S?
You can request a quote for CAS 476463-08-8 - C18H13N3O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 476463-08-8 - C18H13N3O3S?
Yes, KEHONG BIO provides custom synthesis services for CAS 476463-08-8 - C18H13N3O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.