![1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione structure](/static/products/903/903200-94-2.png)
1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
TL;DR: 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione (CAS 903200-94-2) is a chemical compound with molecular formula C18H17FN2O2S and molecular weight 344.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-3-methyl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione
Also Known As: 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione, 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione, 1-[(4-fluorophenyl)methyl]-3-methyl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione
| Molecular Formula | C18H17FN2O2S |
|---|---|
| Molecular Weight | 344.10 g/mol |
| LogP | 2.8279 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.0995 |
| Heavy Atoms | 24 |
| Complexity | 1044.0416 |
Chemical Identifiers
| CAS Number | 903200-94-2 |
|---|---|
| SMILES | CN1C(=O)C2=C(C3=C(S2)CCCC3)N(C1=O)CC4=CC=C(C=C4)F |
Product Overview
1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione (CAS 903200-94-2), with molecular formula C18H17FN2O2S and molecular weight 344.10 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-3-methyl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione.
Chemical Property Profile of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Property Insights of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.8279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione. With a topological polar surface area (TPSA) of 44.0 Ų, 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione has 0 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 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The CAS number of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is 903200-94-2.
What is the molecular formula of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is C18H17FN2O2S.
What is the molecular weight of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is 344.10 g/mol.
Where can I buy 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-fluorobenzyl)-3-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.