RefChem:1081186
TL;DR: RefChem:1081186 (CAS 21001-46-7) is a chemical compound with molecular formula C19H27ClN2O2 and molecular weight 350.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonyloxy)ethyl]azanium chloride
Also Known As: Carbazole-3-carboxylic acid, 5,6,7,8-tetrahydro-, 2-(diethylamino)ethyl ester, hydrochloride, 5,6,7,8-Tetrahydro-3-carbazolecarboxylic acid 2-(diethylamino)ethyl ester hydrochloride, diethyl-[2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonyloxy)ethyl]azanium chloride, RefChem:1081186
| Molecular Formula | C19H27ClN2O2 |
|---|---|
| Molecular Weight | 350.18 g/mol |
| LogP | -0.87 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 350.17612 |
| Heavy Atoms | 24 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 21001-46-7 |
|---|---|
| SMILES | CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)NC3=C2CCCC3.[Cl-] |
| InChIKey | JZGJDRBSQORITP-UHFFFAOYSA-N |
Product Overview
RefChem:1081186 (CAS 21001-46-7), with molecular formula C19H27ClN2O2 and molecular weight 350.18 g/mol. IUPAC: diethyl-[2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonyloxy)ethyl]azanium chloride.
Chemical Property Profile of RefChem:1081186
Property Insights of RefChem:1081186
The XLogP value of -0.87 indicates that RefChem:1081186 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, RefChem:1081186 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1081186 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 RefChem:1081186?
The CAS number of RefChem:1081186 is 21001-46-7.
What is the molecular formula of RefChem:1081186?
The molecular formula of RefChem:1081186 is C19H27ClN2O2.
What is the molecular weight of RefChem:1081186?
The molecular weight of RefChem:1081186 is 350.18 g/mol.
Where can I buy RefChem:1081186?
You can request a quote for RefChem:1081186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1081186?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1081186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.