Mdl 27324
TL;DR: Mdl 27324 (CAS 123285-50-7) is a chemical compound with molecular formula C29H38F3N5O6S and molecular weight 641.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propanoyl]amino]propanoyl]-1-[(3S)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide
Also Known As: Mdl 27324, Dansyl-ala-ala-pro-val-CF3, Mdl 27,324, (2S)-N-[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propanoyl]amino]propanoyl]-1-[(3S)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide, L-Prolinamide, N-((5-(dimethylamino)-1-naphthalenyl)sulfonyl)-L-alanyl-L-alanyl-N-(3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl)-, (S)-
| Molecular Formula | C29H38F3N5O6S |
|---|---|
| Molecular Weight | 641.25 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 641.2495 |
| Heavy Atoms | 44 |
| Complexity | 1170.0 |
Chemical Identifiers
| CAS Number | 123285-50-7 |
|---|---|
| SMILES | C[C@@H](C(=O)NC(=O)[C@@H]1CCCN1[C@@H](C(C)C)C(=O)C(F)(F)F)NC(=O)[C@H](C)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C |
| InChIKey | VYBNKZKFRCAZLU-OVFSYLBISA-N |
Product Overview
Mdl 27324 (CAS 123285-50-7), with molecular formula C29H38F3N5O6S and molecular weight 641.25 g/mol. IUPAC: (2S)-N-[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propanoyl]amino]propanoyl]-1-[(3S)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide.
Chemical Property Profile of Mdl 27324
Property Insights of Mdl 27324
The XLogP value of 4.4 indicates that Mdl 27324 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting Mdl 27324 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mdl 27324 has 3 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 Mdl 27324?
The CAS number of Mdl 27324 is 123285-50-7.
What is the molecular formula of Mdl 27324?
The molecular formula of Mdl 27324 is C29H38F3N5O6S.
What is the molecular weight of Mdl 27324?
The molecular weight of Mdl 27324 is 641.25 g/mol.
Where can I buy Mdl 27324?
You can request a quote for Mdl 27324 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mdl 27324?
Yes, KEHONG BIO provides custom synthesis services for Mdl 27324 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.