A3773/0160090
TL;DR: A3773/0160090 (CAS 727677-22-7) is a chemical compound with molecular formula C17H22N4OS and molecular weight 330.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Also Known As: A3773/0160090, 1-(2-phenylethyl)-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one, 1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one, 1-phenethyl-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one, 1-phenethyl-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
| Molecular Formula | C17H22N4OS |
|---|---|
| Molecular Weight | 330.15 g/mol |
| LogP | 2.74359 |
| Topological Polar Surface Area | 53.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.15143 |
| Heavy Atoms | 23 |
| Complexity | 781.4158 |
Chemical Identifiers
| CAS Number | 727677-22-7 |
|---|---|
| SMILES | CCCN1CC2=C(NC1)N(C(=S)NC2=O)CCC3=CC=CC=C3 |
Product Overview
A3773/0160090 (CAS 727677-22-7), with molecular formula C17H22N4OS and molecular weight 330.15 g/mol. IUPAC: 1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one.
Chemical Property Profile of A3773/0160090
Property Insights of A3773/0160090
The XLogP value of 2.74359 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3773/0160090. With a topological polar surface area (TPSA) of 53.06 Ų, A3773/0160090 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3773/0160090 has 2 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 A3773/0160090?
The CAS number of A3773/0160090 is 727677-22-7.
What is the molecular formula of A3773/0160090?
The molecular formula of A3773/0160090 is C17H22N4OS.
What is the molecular weight of A3773/0160090?
The molecular weight of A3773/0160090 is 330.15 g/mol.
Where can I buy A3773/0160090?
You can request a quote for A3773/0160090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3773/0160090?
Yes, KEHONG BIO provides custom synthesis services for A3773/0160090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.