GIH6X0GHAP
TL;DR: GIH6X0GHAP (CAS 253306-39-7) is a chemical compound with molecular formula C31H48N4O4S2 and molecular weight 604.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (4R)-4-[[(2R)-1-[(1-benzylpiperidin-4-yl)amino]-3-(cyclohexylmethylsulfanyl)-1-oxopropan-2-yl]carbamoyl]-1,3-thiazolidine-3-carboxylate
Also Known As: J1.795.941G, tert-Butyl (4R)-4-((((1R)-2-((1-benzylpiperidin-4-yl)amino)-1-(((cyclohexylmethyl)thio)methyl)-2-oxoethyl)amino)carbonyl)-1,3-thiazolidine-3-carboxylate, 3-Thiazolidinecarboxylic acid, 4-((((1R)-1-(((cyclohexylmethyl)thio)methyl)-2-oxo-2-((1-(phenylmethyl)-4-piperidinyl)amino)ethyl)amino)carbonyl)-, 1,1-dimethylethyl ester, (4R)-, (4R)-4-[[(1R)-1-[(1-Benzyl-4-piperidinyl)carbamoyl]-2-[(cyclohexylmethyl)thio]ethyl]carbamoyl]thiazolidine-3-carboxylic acid tert-butyl ester, (R)-4-[(R)-1-(1-Benzyl-piperidin-4-ylcarbamoyl)-2-cyclohexylmethylsulfanyl-ethylcarbamoyl]-thiazolidine-3-carboxylic acid tert-butyl ester
| Molecular Formula | C31H48N4O4S2 |
|---|---|
| Molecular Weight | 604.31 g/mol |
| LogP | 4.8755 |
| Topological Polar Surface Area | 90.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 604.3117 |
| Heavy Atoms | 41 |
| Complexity | 991.58203 |
Chemical Identifiers
| CAS Number | 253306-39-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N[C@@H](CSCC2CCCCC2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4 |
Product Overview
GIH6X0GHAP (CAS 253306-39-7), with molecular formula C31H48N4O4S2 and molecular weight 604.31 g/mol. IUPAC: tert-butyl (4R)-4-[[(2R)-1-[(1-benzylpiperidin-4-yl)amino]-3-(cyclohexylmethylsulfanyl)-1-oxopropan-2-yl]carbamoyl]-1,3-thiazolidine-3-carboxylate.
Chemical Property Profile of GIH6X0GHAP
Property Insights of GIH6X0GHAP
The XLogP value of 4.8755 indicates that GIH6X0GHAP is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.98 Ų falls within the moderate polarity range, balancing permeability and solubility for GIH6X0GHAP. Following Lipinski's Rule of Five, GIH6X0GHAP has 2 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 GIH6X0GHAP?
The CAS number of GIH6X0GHAP is 253306-39-7.
What is the molecular formula of GIH6X0GHAP?
The molecular formula of GIH6X0GHAP is C31H48N4O4S2.
What is the molecular weight of GIH6X0GHAP?
The molecular weight of GIH6X0GHAP is 604.31 g/mol.
Where can I buy GIH6X0GHAP?
You can request a quote for GIH6X0GHAP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GIH6X0GHAP?
Yes, KEHONG BIO provides custom synthesis services for GIH6X0GHAP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.