![(2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide structure](/static/products/956/956685-95-3.png)
(2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide
TL;DR: (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide (CAS 956685-95-3) is a chemical compound with molecular formula C24H30N4O3 and molecular weight 422.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-cyclopentyl-3-methyl-2-[(2S)-2-methyl-3,5-dioxo-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10,12,14-tetraen-4-yl]butanamide
Also Known As: (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide, (2S)-N-cyclopentyl-3-methyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]butanamide, (S)-N-cyclopentyl-3-methyl-2-((S)-11b-methyl-1,3-dioxo-5,6-dihydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H,11H,11bH)-yl)butanamide
| Molecular Formula | C24H30N4O3 |
|---|---|
| Molecular Weight | 422.23 g/mol |
| LogP | 3.2868 |
| Topological Polar Surface Area | 85.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.23178 |
| Heavy Atoms | 31 |
| Complexity | 1067.9589 |
Chemical Identifiers
| CAS Number | 956685-95-3 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)NC1CCCC1)N2C(=O)[C@@]3(C4=C(CCN3C2=O)C5=CC=CC=C5N4)C |
Product Overview
(2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide (CAS 956685-95-3), with molecular formula C24H30N4O3 and molecular weight 422.23 g/mol. IUPAC: (2S)-N-cyclopentyl-3-methyl-2-[(2S)-2-methyl-3,5-dioxo-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10,12,14-tetraen-4-yl]butanamide.
Chemical Property Profile of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide
Property Insights of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide
The XLogP value of 3.2868 indicates that (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide. Following Lipinski's Rule of Five, (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide has 2 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 (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide?
The CAS number of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide is 956685-95-3.
What is the molecular formula of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide?
The molecular formula of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide is C24H30N4O3.
What is the molecular weight of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide?
The molecular weight of (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide is 422.23 g/mol.
Where can I buy (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide?
You can request a quote for (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(11bS)-1,3-diketo-11b-methyl-6,11-dihydro-5H-imidazo[5,1-a]-carbolin-2-yl]-N-cyclopentyl-3-methyl-butyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.