CAS 476459-39-9 - C23H21N3O3S
TL;DR: CAS 476459-39-9 - C23H21N3O3S (CAS 476459-39-9) is a chemical compound with molecular formula C23H21N3O3S and molecular weight 419.13 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-[2-(3,5-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]prop-2-enamide
Also Known As: (2Z)-3-(2H-1,3-benzodioxol-5-yl)-N-[2-(3,5-dimethylphenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]prop-2-enamide
| Molecular Formula | C23H21N3O3S |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | 4.61654 |
| Topological Polar Surface Area | 65.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.13037 |
| Heavy Atoms | 30 |
| Complexity | 1162.4268 |
Chemical Identifiers
| CAS Number | 476459-39-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C(=C3CSCC3=N2)NC(=O)/C=C/C4=CC5=C(C=C4)OCO5)C |
Product Overview
CAS 476459-39-9 - C23H21N3O3S (CAS 476459-39-9), with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol. IUPAC: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(3,5-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]prop-2-enamide.
Chemical Property Profile of CAS 476459-39-9 - C23H21N3O3S
Property Insights of CAS 476459-39-9 - C23H21N3O3S
The XLogP value of 4.61654 indicates that CAS 476459-39-9 - C23H21N3O3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.38 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 476459-39-9 - C23H21N3O3S. Following Lipinski's Rule of Five, CAS 476459-39-9 - C23H21N3O3S has 1 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 CAS 476459-39-9 - C23H21N3O3S?
The CAS number of CAS 476459-39-9 - C23H21N3O3S is 476459-39-9.
What is the molecular formula of CAS 476459-39-9 - C23H21N3O3S?
The molecular formula of CAS 476459-39-9 - C23H21N3O3S is C23H21N3O3S.
What is the molecular weight of CAS 476459-39-9 - C23H21N3O3S?
The molecular weight of CAS 476459-39-9 - C23H21N3O3S is 419.13 g/mol.
Where can I buy CAS 476459-39-9 - C23H21N3O3S?
You can request a quote for CAS 476459-39-9 - C23H21N3O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 476459-39-9 - C23H21N3O3S?
Yes, KEHONG BIO provides custom synthesis services for CAS 476459-39-9 - C23H21N3O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.