![(S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate structure](/static/products/956/956049-79-9.png)
(S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate
TL;DR: (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate (CAS 956049-79-9) is a chemical compound with molecular formula C30H32N2O6 and molecular weight 516.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
Also Known As: (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate, (4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
| Molecular Formula | C30H32N2O6 |
|---|---|
| Molecular Weight | 516.23 g/mol |
| LogP | 5.50292 |
| Topological Polar Surface Area | 110.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 516.226 |
| Heavy Atoms | 38 |
| Complexity | 1590.3745 |
Chemical Identifiers
| CAS Number | 956049-79-9 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C3=C2CCCC3)OC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)OC(C)(C)C |
Product Overview
(S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate (CAS 956049-79-9), with molecular formula C30H32N2O6 and molecular weight 516.23 g/mol. IUPAC: (4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate.
Chemical Property Profile of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate
Property Insights of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate
The XLogP value of 5.50292 indicates that (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate. Following Lipinski's Rule of Five, (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate?
The CAS number of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate is 956049-79-9.
What is the molecular formula of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate?
The molecular formula of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate is C30H32N2O6.
What is the molecular weight of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate?
The molecular weight of (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate is 516.23 g/mol.
Where can I buy (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate?
You can request a quote for (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.