![1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one structure](/static/products/488/488812-49-3.png)
1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one
TL;DR: 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one (CAS 488812-49-3) is a chemical compound with molecular formula C26H32N4O and molecular weight 416.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)propan-1-one
Also Known As: 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one, 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one, 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)propan-1-one
| Molecular Formula | C26H32N4O |
|---|---|
| Molecular Weight | 416.26 g/mol |
| LogP | 3.88014 |
| Topological Polar Surface Area | 42.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.2576 |
| Heavy Atoms | 31 |
| Complexity | 1109.7925 |
Chemical Identifiers
| CAS Number | 488812-49-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(C)C(=O)N3CCC4=C(C3)C5=CC=CC=C5N4)C |
Product Overview
1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one (CAS 488812-49-3), with molecular formula C26H32N4O and molecular weight 416.26 g/mol. IUPAC: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)propan-1-one.
Chemical Property Profile of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one
Property Insights of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one
The XLogP value of 3.88014 indicates that 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.58 Ų, 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one 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 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one?
The CAS number of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one is 488812-49-3.
What is the molecular formula of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one?
The molecular formula of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one is C26H32N4O.
What is the molecular weight of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one?
The molecular weight of 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one is 416.26 g/mol.
Where can I buy 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one?
You can request a quote for 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-(4-(2,3-dimethylphenyl)piperazin-1-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.