5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one
TL;DR: 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one (CAS 737815-20-2) is a chemical compound with molecular formula C13H17N3OS and molecular weight 263.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one
Also Known As: 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one, AB00718478-01, AR-434/42808041, 5,6-dimethyl-2-(1-pyrrolidinylmethyl)thieno[2,3-d]pyrimidin-4(3H)-one, 8,9-dimethyl-4-(pyrrolidin-1-ylmethyl)-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-trien-2-one
| Molecular Formula | C13H17N3OS |
|---|---|
| Molecular Weight | 263.11 g/mol |
| LogP | 2.19724 |
| Topological Polar Surface Area | 48.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.10922 |
| Heavy Atoms | 18 |
| Complexity | 637.45917 |
Chemical Identifiers
| CAS Number | 737815-20-2 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)NC(=N2)CN3CCCC3)C |
Product Overview
5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one (CAS 737815-20-2), with molecular formula C13H17N3OS and molecular weight 263.11 g/mol. IUPAC: 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one
Property Insights of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one
The XLogP value of 2.19724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one. With a topological polar surface area (TPSA) of 48.99 Ų, 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one has 1 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 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one?
The CAS number of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one is 737815-20-2.
What is the molecular formula of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one is C13H17N3OS.
What is the molecular weight of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one is 263.11 g/mol.
Where can I buy 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.