![(4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone structure](/static/products/956/956190-16-2.png)
(4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone
TL;DR: (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone (CAS 956190-16-2) is a chemical compound with molecular formula C26H21ClN2O4 and molecular weight 460.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]-(4-chlorophenyl)methanone
Also Known As: (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone, (4-chlorophenyl)[(1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]methanone, [(1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]-(4-chlorophenyl)methanone
| Molecular Formula | C26H21ClN2O4 |
|---|---|
| Molecular Weight | 460.12 g/mol |
| LogP | 5.2446 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 460.119 |
| Heavy Atoms | 33 |
| Complexity | 1239.9065 |
Chemical Identifiers
| CAS Number | 956190-16-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)[C@@H]2[C@H]([C@H]3C=CC4=CC=CC=C4N3[C@H]2C(=O)C5=CC=C(C=C5)Cl)[N+](=O)[O-] |
Product Overview
(4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone (CAS 956190-16-2), with molecular formula C26H21ClN2O4 and molecular weight 460.12 g/mol. IUPAC: [(1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]-(4-chlorophenyl)methanone.
Chemical Property Profile of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone
Property Insights of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone
The XLogP value of 5.2446 indicates that (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone. Following Lipinski's Rule of Five, (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone?
The CAS number of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone is 956190-16-2.
What is the molecular formula of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone?
The molecular formula of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone is C26H21ClN2O4.
What is the molecular weight of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone?
The molecular weight of (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone is 460.12 g/mol.
Where can I buy (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone?
You can request a quote for (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-chlorophenyl)((1R,2S,3R,3aR)-2-(4-methoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.