HOE 140, desArg(10)-
TL;DR: HOE 140, desArg(10)- (CAS 138680-92-9) is a chemical compound with molecular formula C53H77N15O12S and molecular weight 1147.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3aS,7aS)-4-[(2S)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-2-[(2S)-2-[[(2S)-2-amino-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]-3a-[2-[[(2S)-4-hydroxypyrrolidine-2-carbonyl]amino]acetyl]-3-(5,6,7,8-tetrahydroisoquinoline-1-carbonyl)-3,4,5,6,7,7a-hexahydro-1H-indole-2-carboxylic acid
Also Known As: 10-Desarg-hoe 140, Hoe 140, desarg(10)-, Hoe 140, desarginyl(10)-, des-Arg(10)-HOE140, Darg(hyp(3)-thi(5)-dtic(7)-oic(8))desarg(9)-BK
| Molecular Formula | C53H77N15O12S |
|---|---|
| Molecular Weight | 1147.56 g/mol |
| LogP | -4.0938 |
| Topological Polar Surface Area | 471.44 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 27 |
| Exact Mass | 1147.5597 |
| Heavy Atoms | 81 |
| Complexity | 2739.2869 |
Chemical Identifiers
| CAS Number | 138680-92-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CN=C2C(=O)C3[C@@]4([C@H](CCCC4C(=O)[C@@H]5CCCN5C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)N)N[C@@]3(C(=O)[C@H](CO)NC(=O)[C@H](CC6=CC=CS6)N)C(=O)O)C(=O)CNC(=O)[C@@H]7CC(CN7)O |
Product Overview
HOE 140, desArg(10)- (CAS 138680-92-9), with molecular formula C53H77N15O12S and molecular weight 1147.56 g/mol. IUPAC: (2S,3aS,7aS)-4-[(2S)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-2-[(2S)-2-[[(2S)-2-amino-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]-3a-[2-[[(2S)-4-hydroxypyrrolidine-2-carbonyl]amino]acetyl]-3-(5,6,7,8-tetrahydroisoquinoline-1-carbonyl)-3,4,5,6,7,7a-hexahydro-1H-indole-2-carboxylic acid.
Chemical Property Profile of HOE 140, desArg(10)-
Property Insights of HOE 140, desArg(10)-
The XLogP value of -4.0938 indicates that HOE 140, desArg(10)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 471.44 Ų indicates high polarity, suggesting HOE 140, desArg(10)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, HOE 140, desArg(10)- has 14 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of HOE 140, desArg(10)-?
The CAS number of HOE 140, desArg(10)- is 138680-92-9.
What is the molecular formula of HOE 140, desArg(10)-?
The molecular formula of HOE 140, desArg(10)- is C53H77N15O12S.
What is the molecular weight of HOE 140, desArg(10)-?
The molecular weight of HOE 140, desArg(10)- is 1147.56 g/mol.
Where can I buy HOE 140, desArg(10)-?
You can request a quote for HOE 140, desArg(10)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HOE 140, desArg(10)-?
Yes, KEHONG BIO provides custom synthesis services for HOE 140, desArg(10)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.