ChemDiv1_027220
TL;DR: ChemDiv1_027220 (CAS 311320-76-0) is a chemical compound with molecular formula C18H25ClN4O3S2 and molecular weight 444.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1-[5,5-dimethyl-3-(2-morpholin-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea
Also Known As: ChemDiv1_027220, A1239/0056897, 3-(3-chlorophenyl)-1-(5,5-dimethyl-3-(2-morpholinoethyl)-2-thioxothiazolidin-4-yl)-1-hydroxyurea, 3-(3-chlorophenyl)-1-[5,5-dimethyl-3-(2-morpholin-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea, 3-(3-chlorophenyl)-1-{5,5-dimethyl-3-[2-(morpholin-4-yl)ethyl]-2-thioxo-1,3-thiazolidin-4-yl}-1-hydroxyurea
| Molecular Formula | C18H25ClN4O3S2 |
|---|---|
| Molecular Weight | 444.11 g/mol |
| LogP | 3.3337 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.10565 |
| Heavy Atoms | 28 |
| Complexity | 730.5372 |
Chemical Identifiers
| CAS Number | 311320-76-0 |
|---|---|
| SMILES | CC1(C(N(C(=S)S1)CCN2CCOCC2)N(C(=O)NC3=CC(=CC=C3)Cl)O)C |
Product Overview
ChemDiv1_027220 (CAS 311320-76-0), with molecular formula C18H25ClN4O3S2 and molecular weight 444.11 g/mol. IUPAC: 3-(3-chlorophenyl)-1-[5,5-dimethyl-3-(2-morpholin-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea.
Chemical Property Profile of ChemDiv1_027220
Property Insights of ChemDiv1_027220
The XLogP value of 3.3337 indicates that ChemDiv1_027220 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027220. Following Lipinski's Rule of Five, ChemDiv1_027220 has 2 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 ChemDiv1_027220?
The CAS number of ChemDiv1_027220 is 311320-76-0.
What is the molecular formula of ChemDiv1_027220?
The molecular formula of ChemDiv1_027220 is C18H25ClN4O3S2.
What is the molecular weight of ChemDiv1_027220?
The molecular weight of ChemDiv1_027220 is 444.11 g/mol.
Where can I buy ChemDiv1_027220?
You can request a quote for ChemDiv1_027220 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027220?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027220 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.