1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea
TL;DR: 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea (CAS 371954-80-2) is a chemical compound with molecular formula C27H25N5O3S2 and molecular weight 531.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5,5-dimethyl-3-(naphthalen-1-ylcarbamoylamino)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxy-3-naphthalen-1-ylurea
Also Known As: 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea, 1-[5,5-dimethyl-3-(naphthalen-1-ylcarbamoylamino)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxy-3-naphthalen-1-ylurea, 1-{5,5-dimethyl-3-[(naphthalen-1-ylcarbamoyl)amino]-2-thioxo-1,3-thiazolidin-4-yl}-1-hydroxy-3-naphthalen-1-ylurea (non-preferred name)
| Molecular Formula | C27H25N5O3S2 |
|---|---|
| Molecular Weight | 531.14 g/mol |
| LogP | 6.3912 |
| Topological Polar Surface Area | 96.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 531.1399 |
| Heavy Atoms | 37 |
| Complexity | 1515.9998 |
Chemical Identifiers
| CAS Number | 371954-80-2 |
|---|---|
| SMILES | CC1(C(N(C(=S)S1)NC(=O)NC2=CC=CC3=CC=CC=C32)N(C(=O)NC4=CC=CC5=CC=CC=C54)O)C |
Product Overview
1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea (CAS 371954-80-2), with molecular formula C27H25N5O3S2 and molecular weight 531.14 g/mol. IUPAC: 1-[5,5-dimethyl-3-(naphthalen-1-ylcarbamoylamino)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxy-3-naphthalen-1-ylurea.
Chemical Property Profile of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea
Property Insights of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea
The XLogP value of 6.3912 indicates that 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea. Following Lipinski's Rule of Five, 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea?
The CAS number of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea is 371954-80-2.
What is the molecular formula of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea?
The molecular formula of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea is C27H25N5O3S2.
What is the molecular weight of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea?
The molecular weight of 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea is 531.14 g/mol.
Where can I buy 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea?
You can request a quote for 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5,5-dimethyl-3-(3-(naphthalen-1-yl)ureido)-2-thioxothiazolidin-4-yl)-1-hydroxy-3-(naphthalen-1-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.