2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole
TL;DR: 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole (CAS 1023858-98-1) is a chemical compound with molecular formula C11H16N2S and molecular weight 208.10342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyrrolidin-1-yl-4,5,6,7-tetrahydro-1,3-benzothiazole
Also Known As: 2-(pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole, 2-pyrrolidin-1-yl-4,5,6,7-tetrahydrobenzothiazole, 2-pyrrolidin-1-yl-4,5,6,7-tetrahydro-1,3-benzothiazole
Technical Specifications
| Molecular Formula | C11H16N2S |
| Molecular Weight | 208.10342 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 44.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.10342 Da |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
| SMILES | C1CCC2=C(C1)N=C(S2)N3CCCC3 |
| InChIKey | RTWHONGSVPSINT-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole
Property Insights of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole
The XLogP value of 3.0 indicates that 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole?
The CAS number of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole is 1023858-98-1.
What is the molecular formula of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole?
The molecular formula of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole is C11H16N2S.
What is the molecular weight of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole?
The molecular weight of 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole is 208.10342 g/mol.
Where can I buy 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole?
You can request a quote for 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole?
Yes, CoreyChem provides custom synthesis services for 2-(Pyrrolidin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.