C25H21ClN4O4S
TL;DR: C25H21ClN4O4S (CAS 314286-53-8) is a chemical compound with molecular formula C25H21ClN4O4S and molecular weight 508.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(E)-[[2-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]sulfanylacetyl]hydrazinylidene]methyl]phenoxy]acetic acid
Also Known As: (E)-2-(2-((2-(2-((1-(2-chlorobenzyl)-1H-benzo[d]imidazol-2-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetic acid, [2-({2-[1-(2-Chloro-benzyl)-1H-benzoimidazol-2-ylsulfanyl]-acetyl}-hydrazonomethyl)-phenoxy]-acetic acid, REGID_for_CID_9559759
| Molecular Formula | C25H21ClN4O4S |
|---|---|
| Molecular Weight | 508.10 g/mol |
| LogP | 4.4438 |
| Topological Polar Surface Area | 105.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 508.0972 |
| Heavy Atoms | 35 |
| Complexity | 1388.9169 |
Chemical Identifiers
| CAS Number | 314286-53-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C3=CC=CC=C3N=C2SCC(=O)N/N=C/C4=CC=CC=C4OCC(=O)O)Cl |
Product Overview
C25H21ClN4O4S (CAS 314286-53-8), with molecular formula C25H21ClN4O4S and molecular weight 508.10 g/mol. IUPAC: 2-[2-[(E)-[[2-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]sulfanylacetyl]hydrazinylidene]methyl]phenoxy]acetic acid.
Chemical Property Profile of C25H21ClN4O4S
Property Insights of C25H21ClN4O4S
The XLogP value of 4.4438 indicates that C25H21ClN4O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.81 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H21ClN4O4S. Following Lipinski's Rule of Five, C25H21ClN4O4S has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C25H21ClN4O4S?
The CAS number of C25H21ClN4O4S is 314286-53-8.
What is the molecular formula of C25H21ClN4O4S?
The molecular formula of C25H21ClN4O4S is C25H21ClN4O4S.
What is the molecular weight of C25H21ClN4O4S?
The molecular weight of C25H21ClN4O4S is 508.10 g/mol.
Where can I buy C25H21ClN4O4S?
You can request a quote for C25H21ClN4O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H21ClN4O4S?
Yes, KEHONG BIO provides custom synthesis services for C25H21ClN4O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.