![2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- structure](/static/products/1951/195191-15-2.webp)
2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-
TL;DR: 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- (CAS 195191-15-2) is a chemical compound with molecular formula C17H14N2O3S and molecular weight 326.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(phenoxathiin-2-ylamino)methyl]pyrrolidine-2,5-dione
Also Known As: NCI60_038083, 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-, 1-[(phenoxathiin-2-ylamino)methyl]pyrrolidine-2,5-dione, 1-{[(PHENOXATHIIN-2-YL)AMINO]METHYL}PYRROLIDINE-2,5-DIONE
| Molecular Formula | C17H14N2O3S |
|---|---|
| Molecular Weight | 326.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.0725 |
| Heavy Atoms | 23 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 195191-15-2 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)CNC2=CC3=C(C=C2)OC4=CC=CC=C4S3 |
| InChIKey | OATLCDUIEUHONI-UHFFFAOYSA-N |
Product Overview
2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- (CAS 195191-15-2), with molecular formula C17H14N2O3S and molecular weight 326.07 g/mol. IUPAC: 1-[(phenoxathiin-2-ylamino)methyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-
Property Insights of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-. Following Lipinski's Rule of Five, 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- 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 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-?
The CAS number of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- is 195191-15-2.
What is the molecular formula of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-?
The molecular formula of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- is C17H14N2O3S.
What is the molecular weight of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-?
The molecular weight of 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- is 326.07 g/mol.
Where can I buy 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-?
You can request a quote for 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Pyrrolidinedione, 1-[(2-phenoxathiinylamino)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.