C15H20N2O4S
TL;DR: C15H20N2O4S (CAS 904511-49-5) is a chemical compound with molecular formula C15H20N2O4S and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxypropyl)-6,12,12-trimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione
Also Known As: 3-(3-hydroxypropyl)-1,6,6-trimethyl-5,6-dihydro-1H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H,8H)-dione, 3-(3-hydroxypropyl)-1,6,6-trimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
| Molecular Formula | C15H20N2O4S |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 0.9954 |
| Topological Polar Surface Area | 73.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.11438 |
| Heavy Atoms | 22 |
| Complexity | 843.8152 |
Chemical Identifiers
| CAS Number | 904511-49-5 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3C)CCCO)C |
Product Overview
C15H20N2O4S (CAS 904511-49-5), with molecular formula C15H20N2O4S and molecular weight 324.11 g/mol. IUPAC: 4-(3-hydroxypropyl)-6,12,12-trimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione.
Chemical Property Profile of C15H20N2O4S
Property Insights of C15H20N2O4S
The XLogP value of 0.9954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C15H20N2O4S. The TPSA of 73.46 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H20N2O4S. Following Lipinski's Rule of Five, C15H20N2O4S has 1 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 C15H20N2O4S?
The CAS number of C15H20N2O4S is 904511-49-5.
What is the molecular formula of C15H20N2O4S?
The molecular formula of C15H20N2O4S is C15H20N2O4S.
What is the molecular weight of C15H20N2O4S?
The molecular weight of C15H20N2O4S is 324.11 g/mol.
Where can I buy C15H20N2O4S?
You can request a quote for C15H20N2O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H20N2O4S?
Yes, KEHONG BIO provides custom synthesis services for C15H20N2O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.