IFLab1_000366
TL;DR: IFLab1_000366 (CAS 325986-97-8) is a chemical compound with molecular formula C14H14N2O2S2 and molecular weight 306.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
Also Known As: IFLab1_000366, IDI1_008585, BAS 05448167, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)thiophene-2-carboxamide
| Molecular Formula | C14H14N2O2S2 |
|---|---|
| Molecular Weight | 306.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.04968 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 325986-97-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3=CC=CS3)C |
| InChIKey | RPDVHHLKHNIXSL-UHFFFAOYSA-N |
Product Overview
IFLab1_000366 (CAS 325986-97-8), with molecular formula C14H14N2O2S2 and molecular weight 306.05 g/mol. IUPAC: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide.
Chemical Property Profile of IFLab1_000366
Property Insights of IFLab1_000366
The XLogP value of 3.4 indicates that IFLab1_000366 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_000366. Following Lipinski's Rule of Five, IFLab1_000366 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 IFLab1_000366?
The CAS number of IFLab1_000366 is 325986-97-8.
What is the molecular formula of IFLab1_000366?
The molecular formula of IFLab1_000366 is C14H14N2O2S2.
What is the molecular weight of IFLab1_000366?
The molecular weight of IFLab1_000366 is 306.05 g/mol.
Where can I buy IFLab1_000366?
You can request a quote for IFLab1_000366 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_000366?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_000366 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.