NCI60_003125
TL;DR: NCI60_003125 (CAS 754140-45-9) is a chemical compound with molecular formula C22H25NO6 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ylethyl 2-(4,9-dimethyl-2-oxofuro[2,3-h]chromen-6-yl)oxyacetate
Also Known As: NCI60_003125, 2-(1-Piperidinyl)ethyl ((4,9-dimethyl-2-oxo-2H-furo(2,3-h)chromen-6-yl)oxy)acetate, 2-(1-Piperidinyl)ethyl ((4,9-dimethyl-2-oxo-2H-furo[2,3-h]chromen-6-yl)oxy)acetate, 2-(1-piperidyl)ethyl 2-(4,9-dimethyl-2-oxo-furo[2,3-h]chromen-6-yl)oxyacetate, 2-piperidin-1-ylethyl 2-(4,9-dimethyl-2-oxofuro[2,3-h]chromen-6-yl)oxyacetate
| Molecular Formula | C22H25NO6 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.16818 |
| Heavy Atoms | 29 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 754140-45-9 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C3C(=COC3=C(C=C12)OCC(=O)OCCN4CCCCC4)C |
| InChIKey | WDJWRKXABZGKAZ-UHFFFAOYSA-N |
Product Overview
NCI60_003125 (CAS 754140-45-9), with molecular formula C22H25NO6 and molecular weight 399.17 g/mol. IUPAC: 2-piperidin-1-ylethyl 2-(4,9-dimethyl-2-oxofuro[2,3-h]chromen-6-yl)oxyacetate.
Chemical Property Profile of NCI60_003125
Property Insights of NCI60_003125
The XLogP value of 3.4 indicates that NCI60_003125 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_003125. Following Lipinski's Rule of Five, NCI60_003125 has 0 hydrogen bond donor(s) and 7 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 NCI60_003125?
The CAS number of NCI60_003125 is 754140-45-9.
What is the molecular formula of NCI60_003125?
The molecular formula of NCI60_003125 is C22H25NO6.
What is the molecular weight of NCI60_003125?
The molecular weight of NCI60_003125 is 399.17 g/mol.
Where can I buy NCI60_003125?
You can request a quote for NCI60_003125 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_003125?
Yes, KEHONG BIO provides custom synthesis services for NCI60_003125 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.