AB00105820-01
TL;DR: AB00105820-01 (CAS 426237-61-8) is a chemical compound with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(2-methylphenyl)urea
Also Known As: AB00105820-01, 1-(5-((2,3-dimethylphenoxy)methyl)-1,3,4-thiadiazol-2-yl)-3-(o-tolyl)urea, 1-[5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(2-methylphenyl)urea, N-{5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-N'-(2-methylphenyl)urea, 1-[(2E)-5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methylphenyl)urea
| Molecular Formula | C19H20N4O2S |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 4.68636 |
| Topological Polar Surface Area | 76.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1307 |
| Heavy Atoms | 26 |
| Complexity | 923.40753 |
Chemical Identifiers
| CAS Number | 426237-61-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)OCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3C)C |
Product Overview
AB00105820-01 (CAS 426237-61-8), with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol. IUPAC: 1-[5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(2-methylphenyl)urea.
Chemical Property Profile of AB00105820-01
Property Insights of AB00105820-01
The XLogP value of 4.68636 indicates that AB00105820-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00105820-01. Following Lipinski's Rule of Five, AB00105820-01 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 AB00105820-01?
The CAS number of AB00105820-01 is 426237-61-8.
What is the molecular formula of AB00105820-01?
The molecular formula of AB00105820-01 is C19H20N4O2S.
What is the molecular weight of AB00105820-01?
The molecular weight of AB00105820-01 is 368.13 g/mol.
Where can I buy AB00105820-01?
You can request a quote for AB00105820-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00105820-01?
Yes, KEHONG BIO provides custom synthesis services for AB00105820-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.