ChemDiv1_028844
TL;DR: ChemDiv1_028844 (CAS 449797-34-6) is a chemical compound with molecular formula C19H20N2O4S and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-dimethyl-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2,7-dioxaspiro[4.4]nonane-1,6-dione
Also Known As: ChemDiv1_028844, SDCCGSBI-0088969.P001, BAS 01900435, 3,8-dimethyl-3-(2-(p-tolylamino)thiazol-4-yl)-2,7-dioxaspiro[4.4]nonane-1,6-dione, 3,8-dimethyl-3-{2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl}-2,7-dioxaspiro[4.4]nonane-1,6-dione
| Molecular Formula | C19H20N2O4S |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 3.67902 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.11438 |
| Heavy Atoms | 26 |
| Complexity | 877.9192 |
Chemical Identifiers
| CAS Number | 449797-34-6 |
|---|---|
| SMILES | CC1CC2(CC(OC2=O)(C)C3=CSC(=N3)NC4=CC=C(C=C4)C)C(=O)O1 |
Product Overview
ChemDiv1_028844 (CAS 449797-34-6), with molecular formula C19H20N2O4S and molecular weight 372.11 g/mol. IUPAC: 3,8-dimethyl-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2,7-dioxaspiro[4.4]nonane-1,6-dione.
Chemical Property Profile of ChemDiv1_028844
Property Insights of ChemDiv1_028844
The XLogP value of 3.67902 indicates that ChemDiv1_028844 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028844. Following Lipinski's Rule of Five, ChemDiv1_028844 has 1 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 ChemDiv1_028844?
The CAS number of ChemDiv1_028844 is 449797-34-6.
What is the molecular formula of ChemDiv1_028844?
The molecular formula of ChemDiv1_028844 is C19H20N2O4S.
What is the molecular weight of ChemDiv1_028844?
The molecular weight of ChemDiv1_028844 is 372.11 g/mol.
Where can I buy ChemDiv1_028844?
You can request a quote for ChemDiv1_028844 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028844?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028844 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.