TimTec1_004042
TL;DR: TimTec1_004042 (CAS 292853-92-0) is a chemical compound with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzoyl-5-methyl-1,13-diazatricyclo[10.3.1.02,7]hexadeca-2(7),3,5-triene-8,16-dione
Also Known As: TimTec1_004042, BAS 00386712, BRD-A70330576-001-01-5, BRD-A70330576-001-02-3, A0497/0023074
| Molecular Formula | C22H22N2O3 |
|---|---|
| Molecular Weight | 362.16 g/mol |
| LogP | 3.21922 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.16306 |
| Heavy Atoms | 27 |
| Complexity | 907.0288 |
Chemical Identifiers
| CAS Number | 292853-92-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N3CCN(C(C3=O)CCCC2=O)C(=O)C4=CC=CC=C4 |
Product Overview
TimTec1_004042 (CAS 292853-92-0), with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol. IUPAC: 13-benzoyl-5-methyl-1,13-diazatricyclo[10.3.1.02,7]hexadeca-2(7),3,5-triene-8,16-dione.
Chemical Property Profile of TimTec1_004042
Property Insights of TimTec1_004042
The XLogP value of 3.21922 indicates that TimTec1_004042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, TimTec1_004042 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_004042 has 0 hydrogen bond donor(s) and 3 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_004042?
The CAS number of TimTec1_004042 is 292853-92-0.
What is the molecular formula of TimTec1_004042?
The molecular formula of TimTec1_004042 is C22H22N2O3.
What is the molecular weight of TimTec1_004042?
The molecular weight of TimTec1_004042 is 362.16 g/mol.
Where can I buy TimTec1_004042?
You can request a quote for TimTec1_004042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_004042?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_004042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.