![4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine structure](/static/products/5329/5329-16-8.webp)
4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine
TL;DR: 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine (CAS 5329-16-8) is a chemical compound with molecular formula C23H21N5O2S2 and molecular weight 463.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzylpiperazin-1-yl)-6-(2-nitrophenyl)sulfanylthieno[2,3-d]pyrimidine
Also Known As: 4-(4-benzylpiperazin-1-yl)-6-(2-nitrophenyl)sulfanylthieno[2,3-d]pyrimidine, 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine
| Molecular Formula | C23H21N5O2S2 |
|---|---|
| Molecular Weight | 463.11 g/mol |
| LogP | 5.0729 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.11368 |
| Heavy Atoms | 32 |
| Complexity | 1239.6191 |
Chemical Identifiers
| CAS Number | 5329-16-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=C4C=C(SC4=NC=N3)SC5=CC=CC=C5[N+](=O)[O-] |
Product Overview
4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine (CAS 5329-16-8), with molecular formula C23H21N5O2S2 and molecular weight 463.11 g/mol. IUPAC: 4-(4-benzylpiperazin-1-yl)-6-(2-nitrophenyl)sulfanylthieno[2,3-d]pyrimidine.
Chemical Property Profile of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine
Property Insights of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine
The XLogP value of 5.0729 indicates that 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine. Following Lipinski's Rule of Five, 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-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-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine?
The CAS number of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine is 5329-16-8.
What is the molecular formula of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine?
The molecular formula of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine is C23H21N5O2S2.
What is the molecular weight of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine?
The molecular weight of 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine is 463.11 g/mol.
Where can I buy 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine?
You can request a quote for 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-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-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Benzylpiperazin-1-yl)-6-[(2-nitrophenyl)sulfanyl]thieno[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.