4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole
TL;DR: 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole (CAS 81322-15-8) is a chemical compound with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole
Also Known As: 4-(4-nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole, 4-(4-nitrophenyl)-2-pyrrolidinyl-1,3-thiazole, AB00761602-01
| Molecular Formula | C13H13N3O2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 3.3185 |
| Topological Polar Surface Area | 59.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.07285 |
| Heavy Atoms | 19 |
| Complexity | 588.19073 |
Chemical Identifiers
| CAS Number | 81322-15-8 |
|---|---|
| SMILES | C1CCN(C1)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole (CAS 81322-15-8), with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol. IUPAC: 4-(4-nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole.
Chemical Property Profile of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole
Property Insights of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole
The XLogP value of 3.3185 indicates that 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.27 Ų, 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole has 0 hydrogen bond donor(s) and 5 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 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The CAS number of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole is 81322-15-8.
What is the molecular formula of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The molecular formula of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole is C13H13N3O2S.
What is the molecular weight of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The molecular weight of 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole is 275.07 g/mol.
Where can I buy 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
You can request a quote for 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Nitrophenyl)-2-pyrrolidin-1-yl-1,3-thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.