AcSerLeuAsnLeu(CHOHCH2)ProIleOMe
TL;DR: AcSerLeuAsnLeu(CHOHCH2)ProIleOMe (CAS 127231-50-9) is a chemical compound with molecular formula C34H61N7O10 and molecular weight 727.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S,3S)-2-[[(2S)-1-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-5-methylhexyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoate
Also Known As: AcSerLeuAsnLeu(CHOHCH2)ProIleOMe, (N-(AcetylSerLeuAsn)-3-amino-2-hydroxy-5-methylhexyl)ProIsoleucine methyl ester, L-Isoleucine, N-(1-(3-((N2-(N-(N-acetyl-L-seryl)-L-leucyl)-L-asparaginyl)amino)-2-hydroxy-5-methylhexyl)-L-prolyl)-, methyl ester, (S-(R*,R*))-, N-Ac-L-Ser-L-Leu-L-Asn-[(2S,3S)-3-Amino*-2-hydroxy-5-methylhexyl]-L-Pro-L-Ile-OMe, 2-{[1-(2-{2-[2-(2-Acetylamino-3-hydroxy-propionylamino)-4-methyl-pentanoylamino]-3-carbamoyl-propionylamino}-1-hydroxy-4-methyl-pentyl)-pyrrolidine-2-carbonyl]-amino}-3-methyl-pentanoic acid methyl ester
| Molecular Formula | C34H61N7O10 |
|---|---|
| Molecular Weight | 727.45 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 23 |
| Exact Mass | 727.448 |
| Heavy Atoms | 51 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 127231-50-9 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)OC)NC(=O)[C@@H]1CCCN1C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C)O |
| InChIKey | KPNCURHVSMVQLI-DVIYOIKASA-N |
Product Overview
AcSerLeuAsnLeu(CHOHCH2)ProIleOMe (CAS 127231-50-9), with molecular formula C34H61N7O10 and molecular weight 727.45 g/mol. IUPAC: methyl (2S,3S)-2-[[(2S)-1-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-5-methylhexyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoate.
Chemical Property Profile of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe
Property Insights of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AcSerLeuAsnLeu(CHOHCH2)ProIleOMe. The TPSA of 259.0 Ų indicates high polarity, suggesting AcSerLeuAsnLeu(CHOHCH2)ProIleOMe may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AcSerLeuAsnLeu(CHOHCH2)ProIleOMe has 8 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe?
The CAS number of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe is 127231-50-9.
What is the molecular formula of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe?
The molecular formula of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe is C34H61N7O10.
What is the molecular weight of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe?
The molecular weight of AcSerLeuAsnLeu(CHOHCH2)ProIleOMe is 727.45 g/mol.
Where can I buy AcSerLeuAsnLeu(CHOHCH2)ProIleOMe?
You can request a quote for AcSerLeuAsnLeu(CHOHCH2)ProIleOMe directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AcSerLeuAsnLeu(CHOHCH2)ProIleOMe?
Yes, KEHONG BIO provides custom synthesis services for AcSerLeuAsnLeu(CHOHCH2)ProIleOMe and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.