TimTec1_004459
TL;DR: TimTec1_004459 (CAS 62236-01-5) is a chemical compound with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetyl-2-phenyl-2H-1,3,4-thiadiazol-5-yl)acetamide
Also Known As: TimTec1_004459, N-(4-acetyl-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide, BAS 00255751, N-(3-acetyl-2-phenyl-2H-1,3,4-thiadiazol-5-yl)acetamide, J3.013.303J
| Molecular Formula | C12H13N3O2S |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 1.6876 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.07285 |
| Heavy Atoms | 18 |
| Complexity | 501.3038 |
Chemical Identifiers
| CAS Number | 62236-01-5 |
|---|---|
| SMILES | CC(=O)NC1=NN(C(S1)C2=CC=CC=C2)C(=O)C |
Product Overview
TimTec1_004459 (CAS 62236-01-5), with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol. IUPAC: N-(3-acetyl-2-phenyl-2H-1,3,4-thiadiazol-5-yl)acetamide.
Chemical Property Profile of TimTec1_004459
Property Insights of TimTec1_004459
The XLogP value of 1.6876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_004459. The TPSA of 61.77 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_004459. Following Lipinski's Rule of Five, TimTec1_004459 has 1 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 TimTec1_004459?
The CAS number of TimTec1_004459 is 62236-01-5.
What is the molecular formula of TimTec1_004459?
The molecular formula of TimTec1_004459 is C12H13N3O2S.
What is the molecular weight of TimTec1_004459?
The molecular weight of TimTec1_004459 is 263.07 g/mol.
Where can I buy TimTec1_004459?
You can request a quote for TimTec1_004459 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_004459?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_004459 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.