CBKinase1_008310
TL;DR: CBKinase1_008310 (CAS 712345-46-5) is a chemical compound with molecular formula C22H28N2O4S and molecular weight 416.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2,3-dihydro-1H-inden-5-yloxy)propan-2-ol
Also Known As: CBKinase1_008310, CBKinase1_020710, BAS 09621358, 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2,3-dihydro-1H-inden-5-yloxy)propan-2-ol, VU0508582-1
| Molecular Formula | C22H28N2O4S |
|---|---|
| Molecular Weight | 416.18 g/mol |
| LogP | 1.9215 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.17697 |
| Heavy Atoms | 29 |
| Complexity | 925.0834 |
Chemical Identifiers
| CAS Number | 712345-46-5 |
|---|---|
| SMILES | C1CC2=C(C1)C=C(C=C2)OCC(CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)O |
Product Overview
CBKinase1_008310 (CAS 712345-46-5), with molecular formula C22H28N2O4S and molecular weight 416.18 g/mol. IUPAC: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2,3-dihydro-1H-inden-5-yloxy)propan-2-ol.
Chemical Property Profile of CBKinase1_008310
Property Insights of CBKinase1_008310
The XLogP value of 1.9215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_008310. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008310. Following Lipinski's Rule of Five, CBKinase1_008310 has 1 hydrogen bond donor(s) and 5 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 CBKinase1_008310?
The CAS number of CBKinase1_008310 is 712345-46-5.
What is the molecular formula of CBKinase1_008310?
The molecular formula of CBKinase1_008310 is C22H28N2O4S.
What is the molecular weight of CBKinase1_008310?
The molecular weight of CBKinase1_008310 is 416.18 g/mol.
Where can I buy CBKinase1_008310?
You can request a quote for CBKinase1_008310 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008310?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008310 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.