![(6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure](/static/products/587/587009-74-3.png)
(6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
TL;DR: (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (CAS 587009-74-3) is a chemical compound with molecular formula C16H16N6O2S and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-[(Z)-pyrrol-2-ylidenemethyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (Z)-6-((1H-pyrrol-2-yl)methylene)-5-imino-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one, 5-amino-2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-[(Z)-pyrrol-2-ylidenemethyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| Molecular Formula | C16H16N6O2S |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 0.8796 |
| Topological Polar Surface Area | 105.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.10553 |
| Heavy Atoms | 25 |
| Complexity | 979.954 |
Chemical Identifiers
| CAS Number | 587009-74-3 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CC2=NN3C(=C(C(=O)N=C3S2)/C=C\4/C=CC=N4)N |
Product Overview
(6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (CAS 587009-74-3), with molecular formula C16H16N6O2S and molecular weight 356.11 g/mol. IUPAC: 5-amino-2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-[(Z)-pyrrol-2-ylidenemethyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Property Insights of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
The XLogP value of 0.8796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one. The TPSA of 105.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one. Following Lipinski's Rule of Five, (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one has 1 hydrogen bond donor(s) and 7 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 (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one?
The CAS number of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one is 587009-74-3.
What is the molecular formula of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one?
The molecular formula of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one is C16H16N6O2S.
What is the molecular weight of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one?
The molecular weight of (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one is 356.11 g/mol.
Where can I buy (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one?
You can request a quote for (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one?
Yes, KEHONG BIO provides custom synthesis services for (6Z)-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.