![3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione structure](/static/products/370/370075-79-9.png)
3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione
TL;DR: 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione (CAS 370075-79-9) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione
Also Known As: 3-benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione, 3-benzyl-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione, 3-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione, 4-benzyl-8-thia-4,6-diazatricyclo[7.4.0.0?,?]trideca-1(9),2(7)-diene-3,5-dione
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 2.6784 |
| Topological Polar Surface Area | 54.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 950.43475 |
Chemical Identifiers
| CAS Number | 370075-79-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)NC(=O)N(C3=O)CC4=CC=CC=C4 |
Product Overview
3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione (CAS 370075-79-9), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: 3-benzyl-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione.
Chemical Property Profile of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione
Property Insights of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione
The XLogP value of 2.6784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione. With a topological polar surface area (TPSA) of 54.86 Ų, 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 3 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 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione?
The CAS number of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione is 370075-79-9.
What is the molecular formula of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione?
The molecular formula of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione is C17H16N2O2S.
What is the molecular weight of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione?
The molecular weight of 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione is 312.09 g/mol.
Where can I buy 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione?
You can request a quote for 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-1,3,5,6,7,8-hexahydrobenzo[b]thiopheno[2,3-d]pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.