4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate
TL;DR: 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate (CAS 956683-75-3) is a chemical compound with molecular formula C27H32N2O6 and molecular weight 480.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl) (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Also Known As: 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate, (4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl) (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate, (R)-4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate
| Molecular Formula | C27H32N2O6 |
|---|---|
| Molecular Weight | 480.23 g/mol |
| LogP | 5.2622 |
| Topological Polar Surface Area | 107.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 480.22604 |
| Heavy Atoms | 35 |
| Complexity | 1258.387 |
Chemical Identifiers
| CAS Number | 956683-75-3 |
|---|---|
| SMILES | CCCC1=CC2=C(C=C1OC(=O)[C@@H](C(C)C)NC(=O)OC(C)(C)C)OC=C(C2=O)C3=CC=CC=N3 |
Product Overview
4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate (CAS 956683-75-3), with molecular formula C27H32N2O6 and molecular weight 480.23 g/mol. IUPAC: (4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl) (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate.
Chemical Property Profile of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate
Property Insights of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate
The XLogP value of 5.2622 indicates that 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate. Following Lipinski's Rule of Five, 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate?
The CAS number of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate is 956683-75-3.
What is the molecular formula of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate?
The molecular formula of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate is C27H32N2O6.
What is the molecular weight of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate?
The molecular weight of 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate is 480.23 g/mol.
Where can I buy 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate?
You can request a quote for 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-6-propyl-3-(pyridin-2-yl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-valinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.