L 654284
TL;DR: L 654284 (CAS 98612-56-7) is a chemical compound with molecular formula C46H67N9O9S2 and molecular weight 953.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2R)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxo-3-sulfanylidenepropan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2R)-3-(4-ethoxyphenyl)-2-[[2-(1-sulfanylcyclohexyl)acetyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]butanediamide
Also Known As: Hbfqmh, PDSP1_001654, PDSP2_001638, L 654284, L-654,284
| Molecular Formula | C46H67N9O9S2 |
|---|---|
| Molecular Weight | 953.45 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 329.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 28 |
| Exact Mass | 953.4503 |
| Heavy Atoms | 66 |
| Complexity | 1640.0 |
Chemical Identifiers
| CAS Number | 98612-56-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C[C@H](C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C=S)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)CC3(CCCCC3)S |
| InChIKey | VNEOOMJYPUDQOL-MDLLQWLJSA-N |
Product Overview
L 654284 (CAS 98612-56-7), with molecular formula C46H67N9O9S2 and molecular weight 953.45 g/mol. IUPAC: (2S)-N-[(2R)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxo-3-sulfanylidenepropan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2R)-3-(4-ethoxyphenyl)-2-[[2-(1-sulfanylcyclohexyl)acetyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]butanediamide.
Chemical Property Profile of L 654284
Property Insights of L 654284
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L 654284. The TPSA of 329.0 Ų indicates high polarity, suggesting L 654284 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L 654284 has 10 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of L 654284?
The CAS number of L 654284 is 98612-56-7.
What is the molecular formula of L 654284?
The molecular formula of L 654284 is C46H67N9O9S2.
What is the molecular weight of L 654284?
The molecular weight of L 654284 is 953.45 g/mol.
Where can I buy L 654284?
You can request a quote for L 654284 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L 654284?
Yes, KEHONG BIO provides custom synthesis services for L 654284 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.