1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol
TL;DR: 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol (CAS 478032-63-2) is a chemical compound with molecular formula C13H12N2OS and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyrimidin-2-ylsulfanyl-2,3-dihydro-1H-inden-2-ol
Also Known As: 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol, 1-(2-pyrimidinylsulfanyl)-2-indanol, 1-pyrimidin-2-ylsulfanyl-2,3-dihydro-1H-inden-2-ol, 1-pyrimidin-2-ylsulfanylindan-2-ol
| Molecular Formula | C13H12N2OS |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 2.227 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.06703 |
| Heavy Atoms | 17 |
| Complexity | 517.8377 |
Chemical Identifiers
| CAS Number | 478032-63-2 |
|---|---|
| SMILES | C1C(C(C2=CC=CC=C21)SC3=NC=CC=N3)O |
Product Overview
1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol (CAS 478032-63-2), with molecular formula C13H12N2OS and molecular weight 244.07 g/mol. IUPAC: 1-pyrimidin-2-ylsulfanyl-2,3-dihydro-1H-inden-2-ol.
Chemical Property Profile of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol
Property Insights of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol
The XLogP value of 2.227 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol. With a topological polar surface area (TPSA) of 46.01 Ų, 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol 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 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol?
The CAS number of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol is 478032-63-2.
What is the molecular formula of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol?
The molecular formula of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol is C13H12N2OS.
What is the molecular weight of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol?
The molecular weight of 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol is 244.07 g/mol.
Where can I buy 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol?
You can request a quote for 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(pyrimidin-2-ylsulfanyl)-2,3-dihydro-1H-inden-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.