![4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine structure](/static/products/714/714937-35-6.png)
4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
TL;DR: 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 714937-35-6) is a chemical compound with molecular formula C24H24N4O2S3 and molecular weight 496.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-methylpropyl)-14-methylsulfanyl-12-[(4-nitrophenyl)methylsulfanyl]-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Also Known As: 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 4-isobutyl-9-(methylthio)-7-((4-nitrobenzyl)thio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C24H24N4O2S3 |
|---|---|
| Molecular Weight | 496.11 g/mol |
| LogP | 6.8491 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.10614 |
| Heavy Atoms | 33 |
| Complexity | 1366.4004 |
Chemical Identifiers
| CAS Number | 714937-35-6 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC(=N4)SC)SCC5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 714937-35-6), with molecular formula C24H24N4O2S3 and molecular weight 496.11 g/mol. IUPAC: 7-(2-methylpropyl)-14-methylsulfanyl-12-[(4-nitrophenyl)methylsulfanyl]-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene.
Chemical Property Profile of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Property Insights of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
The XLogP value of 6.8491 indicates that 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine. Following Lipinski's Rule of Five, 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The CAS number of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine is 714937-35-6.
What is the molecular formula of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The molecular formula of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine is C24H24N4O2S3.
What is the molecular weight of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The molecular weight of 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine is 496.11 g/mol.
Where can I buy 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
You can request a quote for 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-methylpropyl)-9-(methylsulfanyl)-7-[(4-nitrobenzyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.