BAS 13090516
TL;DR: BAS 13090516 (CAS 696616-16-7) is a chemical compound with molecular formula C19H23N3O3S and molecular weight 373.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)sulfonyl]phenyl]pyrrolidin-2-one
Also Known As: BAS 13090516, A3568/0151383, 1-[4-[(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)sulfonyl]phenyl]pyrrolidin-2-one, 1-{4-[(1,6-dimethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl)sulfonyl]phenyl}pyrrolidin-2-one, 1-{4-[(1,6-dimethylpyrrolo[2,1-c]piperazin-2-yl)sulfonyl]phenyl}pyrrolidin-2-o ne
| Molecular Formula | C19H23N3O3S |
|---|---|
| Molecular Weight | 373.15 g/mol |
| LogP | 2.68882 |
| Topological Polar Surface Area | 62.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.14603 |
| Heavy Atoms | 26 |
| Complexity | 946.909 |
Chemical Identifiers
| CAS Number | 696616-16-7 |
|---|---|
| SMILES | CC1C2=CC=C(N2CCN1S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O)C |
Product Overview
BAS 13090516 (CAS 696616-16-7), with molecular formula C19H23N3O3S and molecular weight 373.15 g/mol. IUPAC: 1-[4-[(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)sulfonyl]phenyl]pyrrolidin-2-one.
Chemical Property Profile of BAS 13090516
Property Insights of BAS 13090516
The XLogP value of 2.68882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13090516. The TPSA of 62.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13090516. Following Lipinski's Rule of Five, BAS 13090516 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
Frequently Asked Questions
What is the CAS number of BAS 13090516?
The CAS number of BAS 13090516 is 696616-16-7.
What is the molecular formula of BAS 13090516?
The molecular formula of BAS 13090516 is C19H23N3O3S.
What is the molecular weight of BAS 13090516?
The molecular weight of BAS 13090516 is 373.15 g/mol.
Where can I buy BAS 13090516?
You can request a quote for BAS 13090516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13090516?
Yes, KEHONG BIO provides custom synthesis services for BAS 13090516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.