6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate
TL;DR: 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate (CAS 1009312-93-9) is a chemical compound with molecular formula C21H26ClNO6 and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-4-ethyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
Also Known As: 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate, (6-chloro-4-ethyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate, 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)pentanoate
| Molecular Formula | C21H26ClNO6 |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 4.6076 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.14487 |
| Heavy Atoms | 29 |
| Complexity | 960.02325 |
Chemical Identifiers
| CAS Number | 1009312-93-9 |
|---|---|
| SMILES | CCCC(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)CC)Cl)NC(=O)OC(C)(C)C |
Product Overview
6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate (CAS 1009312-93-9), with molecular formula C21H26ClNO6 and molecular weight 423.14 g/mol. IUPAC: (6-chloro-4-ethyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate.
Chemical Property Profile of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate
Property Insights of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate
The XLogP value of 4.6076 indicates that 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate. Following Lipinski's Rule of Five, 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate has 1 hydrogen bond donor(s) and 6 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 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate?
The CAS number of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate is 1009312-93-9.
What is the molecular formula of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate?
The molecular formula of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate is C21H26ClNO6.
What is the molecular weight of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate?
The molecular weight of 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate is 423.14 g/mol.
Where can I buy 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate?
You can request a quote for 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)norvalinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.