ChemDiv3_003938
TL;DR: ChemDiv3_003938 (CAS 314743-89-0) is a chemical compound with molecular formula C16H16ClNO4 and molecular weight 321.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8-chloro-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]-N,N-dimethylacetamide
Also Known As: ChemDiv3_003938, EiM07-13804, IDI1_021848, BRD-K03928815-001-01-7, 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N,N-dimethylacetamide
| Molecular Formula | C16H16ClNO4 |
|---|---|
| Molecular Weight | 321.08 g/mol |
| LogP | 2.4021 |
| Topological Polar Surface Area | 59.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.07678 |
| Heavy Atoms | 22 |
| Complexity | 809.8785 |
Chemical Identifiers
| CAS Number | 314743-89-0 |
|---|---|
| SMILES | CN(C)C(=O)COC1=C(C=C2C3=C(CCC3)C(=O)OC2=C1)Cl |
Product Overview
ChemDiv3_003938 (CAS 314743-89-0), with molecular formula C16H16ClNO4 and molecular weight 321.08 g/mol. IUPAC: 2-[(8-chloro-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]-N,N-dimethylacetamide.
Chemical Property Profile of ChemDiv3_003938
Property Insights of ChemDiv3_003938
The XLogP value of 2.4021 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_003938. With a topological polar surface area (TPSA) of 59.75 Ų, ChemDiv3_003938 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003938 has 0 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 ChemDiv3_003938?
The CAS number of ChemDiv3_003938 is 314743-89-0.
What is the molecular formula of ChemDiv3_003938?
The molecular formula of ChemDiv3_003938 is C16H16ClNO4.
What is the molecular weight of ChemDiv3_003938?
The molecular weight of ChemDiv3_003938 is 321.08 g/mol.
Where can I buy ChemDiv3_003938?
You can request a quote for ChemDiv3_003938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003938?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.