Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride
TL;DR: Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride (CAS 69538-18-7) is a chemical compound with molecular formula C20H33ClN2O3 and molecular weight 384.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-piperidin-1-ium-1-ylpropyl N-(2-pentoxyphenyl)carbamate chloride
Also Known As: o-(Pentyloxy)carbanilic acid 3-piperidinopropyl ester hydrochloride, Carbamic acid, (2-(pentyloxy)phenyl)-, 3-(1-piperidinyl)propyl ester, monohydrochloride, CARBANILIC ACID, o-(PENTYLOXY)-, 3-PIPERIDINOPROPYL ESTER, HYDROCHLORIDE, 3-piperidin-1-ium-1-ylpropyl N-(2-pentoxyphenyl)carbamate chloride
| Molecular Formula | C20H33ClN2O3 |
|---|---|
| Molecular Weight | 384.22 g/mol |
| LogP | 0.27 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 384.21796 |
| Heavy Atoms | 26 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 69538-18-7 |
|---|---|
| SMILES | CCCCCOC1=CC=CC=C1NC(=O)OCCC[NH+]2CCCCC2.[Cl-] |
| InChIKey | AEAFQTQBOOCENM-UHFFFAOYSA-N |
Product Overview
Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride (CAS 69538-18-7), with molecular formula C20H33ClN2O3 and molecular weight 384.22 g/mol. IUPAC: 3-piperidin-1-ium-1-ylpropyl N-(2-pentoxyphenyl)carbamate chloride.
Chemical Property Profile of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride
Property Insights of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride
The XLogP value of 0.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride. With a topological polar surface area (TPSA) of 52.0 Ų, Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride has 2 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 Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride?
The CAS number of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride is 69538-18-7.
What is the molecular formula of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride?
The molecular formula of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride is C20H33ClN2O3.
What is the molecular weight of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride?
The molecular weight of Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride is 384.22 g/mol.
Where can I buy Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride?
You can request a quote for Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, o-(pentyloxy)-, 3-piperidinopropyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.