Bionet1_000042
TL;DR: Bionet1_000042 (CAS 444151-91-1) is a chemical compound with molecular formula C21H23ClN2O3 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-1,4-dioxonaphthalen-2-yl)-N-cyclopentylpiperidine-4-carboxamide
Also Known As: Bionet1_000042, MixCom2_000163, 1-(3-chloro-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-N-cyclopentyl-4-piperidinecarboxamide, 1-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-cyclopentylpiperidine-4-carboxamide, 5T-0202
| Molecular Formula | C21H23ClN2O3 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 3.2868 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.1397 |
| Heavy Atoms | 27 |
| Complexity | 818.4706 |
Chemical Identifiers
| CAS Number | 444151-91-1 |
|---|---|
| SMILES | C1CCC(C1)NC(=O)C2CCN(CC2)C3=C(C(=O)C4=CC=CC=C4C3=O)Cl |
Product Overview
Bionet1_000042 (CAS 444151-91-1), with molecular formula C21H23ClN2O3 and molecular weight 386.14 g/mol. IUPAC: 1-(3-chloro-1,4-dioxonaphthalen-2-yl)-N-cyclopentylpiperidine-4-carboxamide.
Chemical Property Profile of Bionet1_000042
Property Insights of Bionet1_000042
The XLogP value of 3.2868 indicates that Bionet1_000042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000042. Following Lipinski's Rule of Five, Bionet1_000042 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 Bionet1_000042?
The CAS number of Bionet1_000042 is 444151-91-1.
What is the molecular formula of Bionet1_000042?
The molecular formula of Bionet1_000042 is C21H23ClN2O3.
What is the molecular weight of Bionet1_000042?
The molecular weight of Bionet1_000042 is 386.14 g/mol.
Where can I buy Bionet1_000042?
You can request a quote for Bionet1_000042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000042?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.