(6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one
TL;DR: (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one (CAS 1164522-51-3) is a chemical compound with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Also Known As: (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one, (6Z)-7-IMINO-2-METHYL-6-{[1-(2-PHENOXYETHYL)-1H-PYRROL-2-YL]METHYLIDENE}-5H,6H,7H-[1,2]OXAZOLO[2,3-A]PYRIMIDIN-5-ONE, (6Z)-7-imino-2-methyl-6-{[1-(2-phenoxyethyl)-1H-pyrrol-2-yl]methylidene}-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one, (Z)-7-imino-2-methyl-6-((1-(2-phenoxyethyl)-1H-pyrrol-2-yl)methylene)-6,7-dihydro-5H-isoxazolo[2,3-a]pyrimidin-5-one, 7-Imino-2-methyl-6-[1-[1-(2-phenoxy-ethyl)-1H-pyrrol-2-yl]-meth-(Z)-ylidene]-6,7-dihydro-isoxazolo[2,3-a]pyrimidin-5-one
| Molecular Formula | C20H18N4O3 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 3.01747 |
| Topological Polar Surface Area | 79.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.13788 |
| Heavy Atoms | 27 |
| Complexity | 985.6656 |
Chemical Identifiers
| CAS Number | 1164522-51-3 |
|---|---|
| SMILES | CC1=CC2=NC(=O)/C(=C\C3=CC=CN3CCOC4=CC=CC=C4)/C(=N)N2O1 |
Product Overview
(6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one (CAS 1164522-51-3), with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol. IUPAC: (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one.
Chemical Property Profile of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Property Insights of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one
The XLogP value of 3.01747 indicates that (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.91 Ų falls within the moderate polarity range, balancing permeability and solubility for (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one. Following Lipinski's Rule of Five, (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one has 1 hydrogen bond donor(s) and 4 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)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The CAS number of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one is 1164522-51-3.
What is the molecular formula of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The molecular formula of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one is C20H18N4O3.
What is the molecular weight of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The molecular weight of (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one is 362.14 g/mol.
Where can I buy (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
You can request a quote for (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
Yes, KEHONG BIO provides custom synthesis services for (6Z)-7-imino-2-methyl-6-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-[1,2]oxazolo[2,3-a]pyrimidin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.