![(E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide structure](/static/products/847/847270-34-2.png)
(E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide
TL;DR: (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide (CAS 847270-34-2) is a chemical compound with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-cyano-11-methyl-2-oxo-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]acetamide
Also Known As: (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide, N-[3-Cyano-1-(3-isopropoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylide ne]-acetamide, N-[3-cyano-1-(3-isopropoxypropyl)-5-keto-10-methyl-dipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]acetamide, N-[3-cyano-10-methyl-5-oxidanylidene-1-(3-propan-2-yloxypropyl)dipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]ethanamide, N-[3-cyano-10-methyl-5-oxo-1-(3-propan-2-yloxypropyl)-2-dipyrido[3,4-c:1'',2''-f]pyrimidinylidene]acetamide
| Molecular Formula | C21H23N5O3 |
|---|---|
| Molecular Weight | 393.18 g/mol |
| LogP | 2.0916 |
| Topological Polar Surface Area | 101.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.18008 |
| Heavy Atoms | 29 |
| Complexity | 1261.7515 |
Chemical Identifiers
| CAS Number | 847270-34-2 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=NC(=O)C)N3CCCOC(C)C)C#N |
Product Overview
(E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide (CAS 847270-34-2), with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol. IUPAC: N-[5-cyano-11-methyl-2-oxo-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]acetamide.
Chemical Property Profile of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide
Property Insights of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide
The XLogP value of 2.0916 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide. The TPSA of 101.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide. Following Lipinski's Rule of Five, (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide has 0 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 (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide?
The CAS number of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide is 847270-34-2.
What is the molecular formula of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide?
The molecular formula of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide is C21H23N5O3.
What is the molecular weight of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide?
The molecular weight of (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide is 393.18 g/mol.
Where can I buy (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide?
You can request a quote for (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-cyano-1-(3-isopropoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.