![(S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide structure](/static/products/121/1212103-93-9.png)
(S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide
TL;DR: (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide (CAS 1212103-93-9) is a chemical compound with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-(2-methylpropyl)benzamide
Also Known As: (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide, 4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-methylpropyl)benzamide, 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-(2-methylpropyl)benzamide
| Molecular Formula | C22H23N3O3 |
|---|---|
| Molecular Weight | 377.17 g/mol |
| LogP | 2.9659 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.17395 |
| Heavy Atoms | 28 |
| Complexity | 893.2981 |
Chemical Identifiers
| CAS Number | 1212103-93-9 |
|---|---|
| SMILES | CC(C)CNC(=O)C1=CC=C(C=C1)N2C(=O)[C@@H]3CC4=CC=CC=C4CN3C2=O |
Product Overview
(S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide (CAS 1212103-93-9), with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol. IUPAC: 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-(2-methylpropyl)benzamide.
Chemical Property Profile of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide
Property Insights of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide
The XLogP value of 2.9659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide. Following Lipinski's Rule of Five, (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide has 1 hydrogen bond donor(s) and 3 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 (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide?
The CAS number of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide is 1212103-93-9.
What is the molecular formula of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide?
The molecular formula of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide is C22H23N3O3.
What is the molecular weight of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide?
The molecular weight of (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide is 377.17 g/mol.
Where can I buy (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide?
You can request a quote for (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-isobutylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.