TimTec1_002018
TL;DR: TimTec1_002018 (CAS 299921-22-5) is a chemical compound with molecular formula C18H17N3OS3 and molecular weight 387.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-phenylethyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Also Known As: TimTec1_002018, BRD-A38101898-001-01-2, A2264/0095372, N-(1-phenylethyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide, N-(1-phenylethyl)-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio]acetamide
| Molecular Formula | C18H17N3OS3 |
|---|---|
| Molecular Weight | 387.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.05338 |
| Heavy Atoms | 25 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 299921-22-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)CSC2=NN(C(=S)S2)C3=CC=CC=C3 |
| InChIKey | FABYJJXWDNRPJA-UHFFFAOYSA-N |
Product Overview
TimTec1_002018 (CAS 299921-22-5), with molecular formula C18H17N3OS3 and molecular weight 387.05 g/mol. IUPAC: N-(1-phenylethyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of TimTec1_002018
Property Insights of TimTec1_002018
The XLogP value of 4.8 indicates that TimTec1_002018 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_002018. Following Lipinski's Rule of Five, TimTec1_002018 has 1 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 TimTec1_002018?
The CAS number of TimTec1_002018 is 299921-22-5.
What is the molecular formula of TimTec1_002018?
The molecular formula of TimTec1_002018 is C18H17N3OS3.
What is the molecular weight of TimTec1_002018?
The molecular weight of TimTec1_002018 is 387.05 g/mol.
Where can I buy TimTec1_002018?
You can request a quote for TimTec1_002018 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_002018?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_002018 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.