Benzenesulfonic acid, pentadecyl-, potassium salt
TL;DR: Benzenesulfonic acid, pentadecyl-, potassium salt (CAS 64709-50-8) is a chemical compound with molecular formula C23H27ClN2O2 and molecular weight 398.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 6,7-dihydro-5H-benzo[c]carbazole-10-carboxylate;hydrochloride
Also Known As: Benzenesulfonic acid, pentadecyl-, potassium salt, 7H-Benzo(c)carbazole-10-carboxylic acid, 5,6-dihydro-, 2-(diethylamino)ethyl ester, hydrochloride, 5,6-Dihydro-7H-benzo(c)carbazole-10-carboxylic acid 2-(diethylamino)ethyl ester hydrochloride, 2-diethylaminoethyl 6,7-dihydro-5H-benzo[c]carbazole-10-carboxylate hydrochloride, 2-(Diethylamino)ethyl 6,7-dihydro-5H-benzo[c]carbazole-10-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C23H27ClN2O2 |
|---|---|
| Molecular Weight | 398.18 g/mol |
| LogP | 4.8539 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.17612 |
| Heavy Atoms | 28 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 64709-50-8 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC2=C(C=C1)NC3=C2C4=CC=CC=C4CC3.Cl |
| InChIKey | KJSZBODVMOARHW-UHFFFAOYSA-N |
Product Overview
Benzenesulfonic acid, pentadecyl-, potassium salt (CAS 64709-50-8), with molecular formula C23H27ClN2O2 and molecular weight 398.18 g/mol. IUPAC: 2-(diethylamino)ethyl 6,7-dihydro-5H-benzo[c]carbazole-10-carboxylate;hydrochloride.
Chemical Property Profile of Benzenesulfonic acid, pentadecyl-, potassium salt
Property Insights of Benzenesulfonic acid, pentadecyl-, potassium salt
The XLogP value of 4.8539 indicates that Benzenesulfonic acid, pentadecyl-, potassium salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, Benzenesulfonic acid, pentadecyl-, potassium salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenesulfonic acid, pentadecyl-, potassium salt 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 Benzenesulfonic acid, pentadecyl-, potassium salt?
The CAS number of Benzenesulfonic acid, pentadecyl-, potassium salt is 64709-50-8.
What is the molecular formula of Benzenesulfonic acid, pentadecyl-, potassium salt?
The molecular formula of Benzenesulfonic acid, pentadecyl-, potassium salt is C23H27ClN2O2.
What is the molecular weight of Benzenesulfonic acid, pentadecyl-, potassium salt?
The molecular weight of Benzenesulfonic acid, pentadecyl-, potassium salt is 398.18 g/mol.
Where can I buy Benzenesulfonic acid, pentadecyl-, potassium salt?
You can request a quote for Benzenesulfonic acid, pentadecyl-, potassium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, pentadecyl-, potassium salt?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, pentadecyl-, potassium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.