ChemDiv3_003813
TL;DR: ChemDiv3_003813 (CAS 371217-90-2) is a chemical compound with molecular formula C22H22ClN3O3 and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-[4-(furan-2-carbonyl)piperazin-1-yl]methanone
Also Known As: ChemDiv3_003813, IDI1_021723, BAS 03662633, (6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-[4-(furan-2-carbonyl)piperazin-1-yl]methanone, AH-262/40898251
| Molecular Formula | C22H22ClN3O3 |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.13498 |
| Heavy Atoms | 29 |
| Complexity | 639.0 |
Chemical Identifiers
| CAS Number | 371217-90-2 |
|---|---|
| SMILES | C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)N4CCN(CC4)C(=O)C5=CC=CO5 |
| InChIKey | FRSZNZNJHSDBGI-UHFFFAOYSA-N |
Product Overview
ChemDiv3_003813 (CAS 371217-90-2), with molecular formula C22H22ClN3O3 and molecular weight 411.13 g/mol. IUPAC: (6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-[4-(furan-2-carbonyl)piperazin-1-yl]methanone.
Chemical Property Profile of ChemDiv3_003813
Property Insights of ChemDiv3_003813
The XLogP value of 3.4 indicates that ChemDiv3_003813 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_003813. Following Lipinski's Rule of Five, ChemDiv3_003813 has 1 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 ChemDiv3_003813?
The CAS number of ChemDiv3_003813 is 371217-90-2.
What is the molecular formula of ChemDiv3_003813?
The molecular formula of ChemDiv3_003813 is C22H22ClN3O3.
What is the molecular weight of ChemDiv3_003813?
The molecular weight of ChemDiv3_003813 is 411.13 g/mol.
Where can I buy ChemDiv3_003813?
You can request a quote for ChemDiv3_003813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003813?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.