JMV458
TL;DR: JMV458 (CAS 153723-53-6) is a chemical compound with molecular formula C45H73N13O9 and molecular weight 939.5654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-5-(diaminomethylideneamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid
Also Known As: JMV458, JMV 458, EX-A13268, (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-5-(diaminomethylideneamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid, (2S)-2-[(2S,3S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoyl]pyrrolidin-2-yl]formamido}-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-methylpentanoic acid
Technical Specifications
| Molecular Formula | C45H73N13O9 |
| Molecular Weight | 939.5654 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 357.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 27 |
| Exact Mass | 939.5654 Da |
| Heavy Atoms | 67 |
| Complexity | 1750.0 |
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)OC(C)(C)C |
| InChIKey | KOHSYJYVCLITLX-OLPQHFNPSA-N |
Chemical Property Profile of JMV458
Property Insights of JMV458
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for JMV458. The TPSA of 357.0 Ų indicates high polarity, suggesting JMV458 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, JMV458 has 11 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of JMV458?
The CAS number of JMV458 is 153723-53-6.
What is the molecular formula of JMV458?
The molecular formula of JMV458 is C45H73N13O9.
What is the molecular weight of JMV458?
The molecular weight of JMV458 is 939.5654 g/mol.
Where can I buy JMV458?
You can request a quote for JMV458 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for JMV458?
Yes, CoreyChem provides custom synthesis services for JMV458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.