Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)
TL;DR: Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) (CAS 17091-45-1) is a chemical compound with molecular formula C12H14BrNS and molecular weight 283.00302 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-2,4-dimethyl-1,3-thiazol-3-ium bromide
Also Known As: Cromolynsodium, 3-benzyl-2,4-dimethyl-1,3-thiazol-3-ium bromide, 2,4-Dimethyl-3-benzyl-thiazolium bromide, Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide, 3-benzyl-2,4-dimethyl-1,3-thiazol-3-ium;bromide
Technical Specifications
| Molecular Formula | C12H14BrNS |
| Molecular Weight | 283.00302 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.00302 Da |
| Heavy Atoms | 15 |
| Complexity | 177.0 |
| SMILES | CC1=CSC(=[N+]1CC2=CC=CC=C2)C.[Br-] |
| InChIKey | QUQOMXILDQSQPN-UHFFFAOYSA-M |
Chemical Property Profile of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)
Property Insights of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)
The XLogP value of -0.3 indicates that Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.1 Ų, Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)?
The CAS number of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) is 17091-45-1.
What is the molecular formula of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)?
The molecular formula of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) is C12H14BrNS.
What is the molecular weight of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)?
The molecular weight of Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) is 283.00302 g/mol.
Where can I buy Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)?
You can request a quote for Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1)?
Yes, CoreyChem provides custom synthesis services for Thiazolium, 2,4-dimethyl-3-(phenylmethyl)-, bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.