Coumarin, 3-chloro-4-piperidino-
TL;DR: Coumarin, 3-chloro-4-piperidino- (CAS 36048-07-4) is a chemical compound with molecular formula C14H14ClNO2 and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-piperidin-1-ylchromen-2-one
Also Known As: 3-Chloro-4-piperidinocoumarin, COUMARIN, 3-CHLORO-4-PIPERIDINO-, 3-chloro-4-piperidin-1-ylchromen-2-one, 2H-1-Benzopyran-2-one, 3-chloro-4-(1-piperidinyl)-, 3-chloro-4-(piperidin-1-yl)-2H-chromen-2-one
| Molecular Formula | C14H14ClNO2 |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.07132 |
| Heavy Atoms | 18 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 36048-07-4 |
|---|---|
| SMILES | C1CCN(CC1)C2=C(C(=O)OC3=CC=CC=C32)Cl |
| InChIKey | XGSYNSVLEUYTKS-UHFFFAOYSA-N |
Product Overview
Coumarin, 3-chloro-4-piperidino- (CAS 36048-07-4), with molecular formula C14H14ClNO2 and molecular weight 263.07 g/mol. IUPAC: 3-chloro-4-piperidin-1-ylchromen-2-one.
Chemical Property Profile of Coumarin, 3-chloro-4-piperidino-
Property Insights of Coumarin, 3-chloro-4-piperidino-
The XLogP value of 3.4 indicates that Coumarin, 3-chloro-4-piperidino- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Coumarin, 3-chloro-4-piperidino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coumarin, 3-chloro-4-piperidino- has 0 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 Coumarin, 3-chloro-4-piperidino-?
The CAS number of Coumarin, 3-chloro-4-piperidino- is 36048-07-4.
What is the molecular formula of Coumarin, 3-chloro-4-piperidino-?
The molecular formula of Coumarin, 3-chloro-4-piperidino- is C14H14ClNO2.
What is the molecular weight of Coumarin, 3-chloro-4-piperidino-?
The molecular weight of Coumarin, 3-chloro-4-piperidino- is 263.07 g/mol.
Where can I buy Coumarin, 3-chloro-4-piperidino-?
You can request a quote for Coumarin, 3-chloro-4-piperidino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin, 3-chloro-4-piperidino-?
Yes, KEHONG BIO provides custom synthesis services for Coumarin, 3-chloro-4-piperidino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.