![(S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate structure](/static/products/956/956049-83-5.png)
(S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate
TL;DR: (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate (CAS 956049-83-5) is a chemical compound with molecular formula C26H27NO6 and molecular weight 449.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate
Also Known As: (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate, 6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl N-[(benzyloxy)carbonyl]-L-valinate, (6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate
| Molecular Formula | C26H27NO6 |
|---|---|
| Molecular Weight | 449.18 g/mol |
| LogP | 4.5282 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.18384 |
| Heavy Atoms | 33 |
| Complexity | 1214.6743 |
Chemical Identifiers
| CAS Number | 956049-83-5 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)OC1=CC2=C(C=C1)C3=C(CCCC3)C(=O)O2)NC(=O)OCC4=CC=CC=C4 |
Product Overview
(S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate (CAS 956049-83-5), with molecular formula C26H27NO6 and molecular weight 449.18 g/mol. IUPAC: (6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate.
Chemical Property Profile of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate
Property Insights of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate
The XLogP value of 4.5282 indicates that (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate 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 (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate. Following Lipinski's Rule of Five, (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate 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 (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate?
The CAS number of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate is 956049-83-5.
What is the molecular formula of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate?
The molecular formula of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate is C26H27NO6.
What is the molecular weight of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate?
The molecular weight of (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate is 449.18 g/mol.
Where can I buy (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate?
You can request a quote for (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.