(S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid
TL;DR: (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid (CAS 956236-14-9) is a chemical compound with molecular formula C22H25N3O8 and molecular weight 459.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[[(2S)-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoyl]amino]acetyl]amino]acetic acid
Also Known As: (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid, N-{[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-alanylglycylglycine, 2-(2-{2-[2-({6-OXO-6H,7H,8H,9H,10H-CYCLOHEXA[C]CHROMEN-3-YL}OXY)ACETAMIDO]PROPANAMIDO}ACETAMIDO)ACETIC ACID, 2-[[2-[[(2S)-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoyl]amino]acetyl]amino]acetic acid
| Molecular Formula | C22H25N3O8 |
|---|---|
| Molecular Weight | 459.16 g/mol |
| LogP | -0.1277 |
| Topological Polar Surface Area | 164.04 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.16415 |
| Heavy Atoms | 33 |
| Complexity | 1140.3975 |
Chemical Identifiers
| CAS Number | 956236-14-9 |
|---|---|
| SMILES | C[C@@H](C(=O)NCC(=O)NCC(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCCC3)C(=O)O2 |
Product Overview
(S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid (CAS 956236-14-9), with molecular formula C22H25N3O8 and molecular weight 459.16 g/mol. IUPAC: 2-[[2-[[(2S)-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoyl]amino]acetyl]amino]acetic acid.
Chemical Property Profile of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid
Property Insights of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid
The XLogP value of -0.1277 indicates that (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 164.04 Ų indicates high polarity, suggesting (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid has 4 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 (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid?
The CAS number of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid is 956236-14-9.
What is the molecular formula of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid?
The molecular formula of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid is C22H25N3O8.
What is the molecular weight of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid?
The molecular weight of (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid is 459.16 g/mol.
Where can I buy (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid?
You can request a quote for (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(2-(2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanamido)acetamido)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.