AB00685547-01
TL;DR: AB00685547-01 (CAS 466653-35-0) is a chemical compound with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]-3-(3-hydroxyphenyl)thiourea
Also Known As: AB00685547-01, (2Z)-N-(3-hydroxyphenyl)-2-(5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide, 1-(3-hydroxyphenyl)-3-[(5-methyl-2-oxoindol-3-yl)amino]thiourea, (Z)-N-(3-hydroxyphenyl)-2-(5-methyl-2-oxoindolin-3-ylidene)hydrazinecarbothioamide, 3-[({[(3-hydroxyphenyl)amino]thioxomethyl}amino)azamethylene]-5-methyl-1H-benz o[d]azolin-2-one
| Molecular Formula | C16H14N4O2S |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 4.36822 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.08374 |
| Heavy Atoms | 23 |
| Complexity | 917.5843 |
Chemical Identifiers
| CAS Number | 466653-35-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2N=NC(=S)NC3=CC(=CC=C3)O)O |
Product Overview
AB00685547-01 (CAS 466653-35-0), with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol. IUPAC: 1-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]-3-(3-hydroxyphenyl)thiourea.
Chemical Property Profile of AB00685547-01
Property Insights of AB00685547-01
The XLogP value of 4.36822 indicates that AB00685547-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685547-01. Following Lipinski's Rule of Five, AB00685547-01 has 4 hydrogen bond donor(s) and 4 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 AB00685547-01?
The CAS number of AB00685547-01 is 466653-35-0.
What is the molecular formula of AB00685547-01?
The molecular formula of AB00685547-01 is C16H14N4O2S.
What is the molecular weight of AB00685547-01?
The molecular weight of AB00685547-01 is 326.08 g/mol.
Where can I buy AB00685547-01?
You can request a quote for AB00685547-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685547-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685547-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.