![9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one structure](/static/products/383/383899-94-3.png)
9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one
TL;DR: 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one (CAS 383899-94-3) is a chemical compound with molecular formula C21H16N2OS2 and molecular weight 376.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(3-methylphenyl)-14-sulfanylidene-17-thia-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaen-12-one
Also Known As: 9-mercapto-8-(m-tolyl)-5,6-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(8H)-one, 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one, 8-(3-methylphenyl)-9-thioxo-5,8,9,10-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one, REGID_for_CID_1388232
| Molecular Formula | C21H16N2OS2 |
|---|---|
| Molecular Weight | 376.07 g/mol |
| LogP | 5.18381 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 376.0704 |
| Heavy Atoms | 26 |
| Complexity | 1293.598 |
Chemical Identifiers
| CAS Number | 383899-94-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(NC2=S)SC4=C3CCC5=CC=CC=C54 |
Product Overview
9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one (CAS 383899-94-3), with molecular formula C21H16N2OS2 and molecular weight 376.07 g/mol. IUPAC: 13-(3-methylphenyl)-14-sulfanylidene-17-thia-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaen-12-one.
Chemical Property Profile of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one
Property Insights of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one
The XLogP value of 5.18381 indicates that 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one has 1 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 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one?
The CAS number of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one is 383899-94-3.
What is the molecular formula of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one?
The molecular formula of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one is C21H16N2OS2.
What is the molecular weight of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one?
The molecular weight of 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one is 376.07 g/mol.
Where can I buy 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one?
You can request a quote for 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one?
Yes, KEHONG BIO provides custom synthesis services for 9-Mercapto-8-m-tolyl-5,8-dihydro-6H-11-thia-8,10-diaza-benzo[a]fluoren-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.