BAS 00341475
TL;DR: BAS 00341475 (CAS 61997-76-0) is a chemical compound with molecular formula C15H19NO and molecular weight 229.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-3-(2-methylanilino)cyclohex-2-en-1-one
Also Known As: BAS 00341475, 5,5-Dimethyl-3-o-tolylamino-cyclohex-2-enone, 5,5-dimethyl-3-(2-methylanilino)cyclohex-2-en-1-one, 5,5-dimethyl-3-[(2-methylphenyl)amino]cyclohex-2-en-1-one, 5,5-dimethyl-3-o-toluidino-cyclohex-2-enone
| Molecular Formula | C15H19NO |
|---|---|
| Molecular Weight | 229.15 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.14667 |
| Heavy Atoms | 17 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 61997-76-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=CC(=O)CC(C2)(C)C |
| InChIKey | SOPAHYKHHSLSLX-UHFFFAOYSA-N |
Product Overview
BAS 00341475 (CAS 61997-76-0), with molecular formula C15H19NO and molecular weight 229.15 g/mol. IUPAC: 5,5-dimethyl-3-(2-methylanilino)cyclohex-2-en-1-one.
Chemical Property Profile of BAS 00341475
Property Insights of BAS 00341475
The XLogP value of 3.4 indicates that BAS 00341475 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, BAS 00341475 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00341475 has 1 hydrogen bond donor(s) and 2 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 BAS 00341475?
The CAS number of BAS 00341475 is 61997-76-0.
What is the molecular formula of BAS 00341475?
The molecular formula of BAS 00341475 is C15H19NO.
What is the molecular weight of BAS 00341475?
The molecular weight of BAS 00341475 is 229.15 g/mol.
Where can I buy BAS 00341475?
You can request a quote for BAS 00341475 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00341475?
Yes, KEHONG BIO provides custom synthesis services for BAS 00341475 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.