HEPT-H
TL;DR: HEPT-H (CAS 125056-74-8) is a chemical compound with molecular formula C14H22N2O4S and molecular weight 314.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-cyclohexylsulfanyl-1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione
Also Known As: HEPT-H, HEPT deriv., 6-Cyclohexylthio-1-((2-hydroxyethoxy)methyl)thymine, 1-(2-Hydroxyethoxymethyl)-6-cyclohexylthiothymine, 2,4(1H,3H)-Pyrimidinedione, 6-(cyclohexylthio)-1-((2-hydroxyethoxy)methyl)-5-methyl-
| Molecular Formula | C14H22N2O4S |
|---|---|
| Molecular Weight | 314.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.13004 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 125056-74-8 |
|---|---|
| SMILES | CC1=C(N(C(=O)NC1=O)COCCO)SC2CCCCC2 |
| InChIKey | BZCOQGWLGFBFIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
HEPT-H (CAS 125056-74-8), with molecular formula C14H22N2O4S and molecular weight 314.13 g/mol. IUPAC: 6-cyclohexylsulfanyl-1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of HEPT-H
Property Insights of HEPT-H
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for HEPT-H. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for HEPT-H. Following Lipinski's Rule of Five, HEPT-H has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of HEPT-H?
The CAS number of HEPT-H is 125056-74-8.
What is the molecular formula of HEPT-H?
The molecular formula of HEPT-H is C14H22N2O4S.
What is the molecular weight of HEPT-H?
The molecular weight of HEPT-H is 314.13 g/mol.
Where can I buy HEPT-H?
You can request a quote for HEPT-H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HEPT-H?
Yes, KEHONG BIO provides custom synthesis services for HEPT-H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.