ChemDiv1_024044
TL;DR: ChemDiv1_024044 (CAS 332873-97-9) is a chemical compound with molecular formula C29H40N4O2 and molecular weight 476.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[11-[2-(4-methylpiperazin-1-yl)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propylpentanamide
Also Known As: ChemDiv1_024044, BAS 01947518, BIM-0047121.P001, N-[11-[2-(4-methylpiperazin-1-yl)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propylpentanamide, N-{5-[(4-METHYL-1-PIPERAZINYL)ACETYL]-10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-3-YL}-2-PROPYLPENTANAMIDE
| Molecular Formula | C29H40N4O2 |
|---|---|
| Molecular Weight | 476.32 g/mol |
| LogP | 4.8522 |
| Topological Polar Surface Area | 55.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.31512 |
| Heavy Atoms | 35 |
| Complexity | 1023.09186 |
Chemical Identifiers
| CAS Number | 332873-97-9 |
|---|---|
| SMILES | CCCC(CCC)C(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CN4CCN(CC4)C)C=C1 |
Product Overview
ChemDiv1_024044 (CAS 332873-97-9), with molecular formula C29H40N4O2 and molecular weight 476.32 g/mol. IUPAC: N-[11-[2-(4-methylpiperazin-1-yl)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propylpentanamide.
Chemical Property Profile of ChemDiv1_024044
Property Insights of ChemDiv1_024044
The XLogP value of 4.8522 indicates that ChemDiv1_024044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.89 Ų, ChemDiv1_024044 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_024044 has 1 hydrogen bond donor(s) and 4 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 ChemDiv1_024044?
The CAS number of ChemDiv1_024044 is 332873-97-9.
What is the molecular formula of ChemDiv1_024044?
The molecular formula of ChemDiv1_024044 is C29H40N4O2.
What is the molecular weight of ChemDiv1_024044?
The molecular weight of ChemDiv1_024044 is 476.32 g/mol.
Where can I buy ChemDiv1_024044?
You can request a quote for ChemDiv1_024044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024044?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.