![3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione structure](/static/products/903/903205-72-1.png)
3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
TL;DR: 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione (CAS 903205-72-1) is a chemical compound with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,11,11-trimethyl-3-(2-phenylethyl)-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-4,6-dione
Also Known As: 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione, 3,7,7-trimethyl-1-phenethyl-6,7-dihydro-1H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(3H,9H)-dione
| Molecular Formula | C20H22N2O3S |
|---|---|
| Molecular Weight | 370.14 g/mol |
| LogP | 2.8557 |
| Topological Polar Surface Area | 53.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.1351 |
| Heavy Atoms | 26 |
| Complexity | 1090.1722 |
Chemical Identifiers
| CAS Number | 903205-72-1 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=C(S2)C(=O)N(C(=O)N3CCC4=CC=CC=C4)C)C |
Product Overview
3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione (CAS 903205-72-1), with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol. IUPAC: 5,11,11-trimethyl-3-(2-phenylethyl)-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-4,6-dione.
Chemical Property Profile of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Property Insights of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.8557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione. With a topological polar surface area (TPSA) of 53.23 Ų, 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':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, 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione has 0 hydrogen bond donor(s) and 4 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 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The CAS number of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is 903205-72-1.
What is the molecular formula of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is C20H22N2O3S.
What is the molecular weight of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione is 370.14 g/mol.
Where can I buy 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':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 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,7,7-trimethyl-1-(2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':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.