UPCMLD0ENAT5440435:001
TL;DR: UPCMLD0ENAT5440435:001 (CAS 497082-38-9) is a chemical compound with molecular formula C19H17N3O3S2 and molecular weight 399.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-[(2-methylphenyl)carbamothioyl]acetamide
Also Known As: UPCMLD0ENAT5440435:001, 2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-[(2-methylphenyl)carbamothioyl]acetamide, AT-057/41290441, 2-(2,4-dioxo-3-phenylthiazolidin-5-yl)-N-(o-tolylcarbamothioyl)acetamide, N-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)acetyl]-N'-(2-methylphenyl)thiourea
| Molecular Formula | C19H17N3O3S2 |
|---|---|
| Molecular Weight | 399.07 g/mol |
| LogP | 3.46672 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.07114 |
| Heavy Atoms | 27 |
| Complexity | 902.0827 |
Chemical Identifiers
| CAS Number | 497082-38-9 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NC(=O)CC2C(=O)N(C(=O)S2)C3=CC=CC=C3 |
Product Overview
UPCMLD0ENAT5440435:001 (CAS 497082-38-9), with molecular formula C19H17N3O3S2 and molecular weight 399.07 g/mol. IUPAC: 2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-[(2-methylphenyl)carbamothioyl]acetamide.
Chemical Property Profile of UPCMLD0ENAT5440435:001
Property Insights of UPCMLD0ENAT5440435:001
The XLogP value of 3.46672 indicates that UPCMLD0ENAT5440435:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5440435:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5440435:001 has 2 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 UPCMLD0ENAT5440435:001?
The CAS number of UPCMLD0ENAT5440435:001 is 497082-38-9.
What is the molecular formula of UPCMLD0ENAT5440435:001?
The molecular formula of UPCMLD0ENAT5440435:001 is C19H17N3O3S2.
What is the molecular weight of UPCMLD0ENAT5440435:001?
The molecular weight of UPCMLD0ENAT5440435:001 is 399.07 g/mol.
Where can I buy UPCMLD0ENAT5440435:001?
You can request a quote for UPCMLD0ENAT5440435:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5440435:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5440435:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.