TimTec1_000088
TL;DR: TimTec1_000088 (CAS 307337-62-8) is a chemical compound with molecular formula C23H17NOS and molecular weight 355.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(3-methylphenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one
Also Known As: TimTec1_000088, BAS 00458961, BRD-A32433614-001-01-8, 10-(3-methylphenyl)-9-thia-2-azatetracyclo[9.7.0.0^{3,8}.0^{13,18}]octadeca-1,3(8),4,6,13(18),14,16-heptaen-12-one, 11-m-Tolyl-11,11a-dihydro-10-thia-5-aza-dibenzo[a,g]azulen-12-one
| Molecular Formula | C23H17NOS |
|---|---|
| Molecular Weight | 355.10 g/mol |
| LogP | 5.77532 |
| Topological Polar Surface Area | 29.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 355.1031 |
| Heavy Atoms | 26 |
| Complexity | 1069.0627 |
Chemical Identifiers
| CAS Number | 307337-62-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2C3C(=NC4=CC=CC=C4S2)C5=CC=CC=C5C3=O |
Product Overview
TimTec1_000088 (CAS 307337-62-8), with molecular formula C23H17NOS and molecular weight 355.10 g/mol. IUPAC: 11-(3-methylphenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one.
Chemical Property Profile of TimTec1_000088
Property Insights of TimTec1_000088
The XLogP value of 5.77532 indicates that TimTec1_000088 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.43 Ų, TimTec1_000088 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_000088 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TimTec1_000088?
The CAS number of TimTec1_000088 is 307337-62-8.
What is the molecular formula of TimTec1_000088?
The molecular formula of TimTec1_000088 is C23H17NOS.
What is the molecular weight of TimTec1_000088?
The molecular weight of TimTec1_000088 is 355.10 g/mol.
Where can I buy TimTec1_000088?
You can request a quote for TimTec1_000088 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_000088?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_000088 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.