Cbz-DL-Cys(Trt)-DL-His-OMe
TL;DR: Cbz-DL-Cys(Trt)-DL-His-OMe (CAS 23435-45-2) is a chemical compound with molecular formula C37H36N4O5S and molecular weight 648.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(1H-imidazol-5-yl)-2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]propanoate
Also Known As: Cbz-DL-Cys(Trt)-DL-His-OMe, methyl n-[(benzyloxy)carbonyl]-s-tritylcysteinylhistidinate, 2-{[(Benzyloxy)(hydroxy)methylidene]amino}-N-[3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]-3-[(triphenylmethyl)sulfanyl]propanimidic acid, methyl 3-(1H-imidazol-5-yl)-2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]propanoate
| Molecular Formula | C37H36N4O5S |
|---|---|
| Molecular Weight | 648.24 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 648.24066 |
| Heavy Atoms | 47 |
| Complexity | 930.0 |
Chemical Identifiers
| CAS Number | 23435-45-2 |
|---|---|
| SMILES | COC(=O)C(CC1=CN=CN1)NC(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5 |
| InChIKey | LDHMHOFHMJMMKK-UHFFFAOYSA-N |
Product Overview
Cbz-DL-Cys(Trt)-DL-His-OMe (CAS 23435-45-2), with molecular formula C37H36N4O5S and molecular weight 648.24 g/mol. IUPAC: methyl 3-(1H-imidazol-5-yl)-2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]propanoate.
Chemical Property Profile of Cbz-DL-Cys(Trt)-DL-His-OMe
Property Insights of Cbz-DL-Cys(Trt)-DL-His-OMe
The XLogP value of 6.2 indicates that Cbz-DL-Cys(Trt)-DL-His-OMe is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting Cbz-DL-Cys(Trt)-DL-His-OMe may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cbz-DL-Cys(Trt)-DL-His-OMe has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cbz-DL-Cys(Trt)-DL-His-OMe?
The CAS number of Cbz-DL-Cys(Trt)-DL-His-OMe is 23435-45-2.
What is the molecular formula of Cbz-DL-Cys(Trt)-DL-His-OMe?
The molecular formula of Cbz-DL-Cys(Trt)-DL-His-OMe is C37H36N4O5S.
What is the molecular weight of Cbz-DL-Cys(Trt)-DL-His-OMe?
The molecular weight of Cbz-DL-Cys(Trt)-DL-His-OMe is 648.24 g/mol.
Where can I buy Cbz-DL-Cys(Trt)-DL-His-OMe?
You can request a quote for Cbz-DL-Cys(Trt)-DL-His-OMe directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cbz-DL-Cys(Trt)-DL-His-OMe?
Yes, KEHONG BIO provides custom synthesis services for Cbz-DL-Cys(Trt)-DL-His-OMe and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.