![1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide structure](/static/products/896/896846-63-2.png)
1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
TL;DR: 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide (CAS 896846-63-2) is a chemical compound with molecular formula C25H27N5O3 and molecular weight 445.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-10-methyl-N-(2-morpholin-4-ylethyl)-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, 1-benzyl-9-methyl-N-(2-morpholinoethyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
| Molecular Formula | C25H27N5O3 |
|---|---|
| Molecular Weight | 445.21 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.2114 |
| Heavy Atoms | 33 |
| Complexity | 841.0 |
Chemical Identifiers
| CAS Number | 896846-63-2 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(N3CC4=CC=CC=C4)C(=O)NCCN5CCOCC5 |
| InChIKey | SWTQYMJBQVWFPQ-UHFFFAOYSA-N |
Product Overview
1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide (CAS 896846-63-2), with molecular formula C25H27N5O3 and molecular weight 445.21 g/mol. IUPAC: 6-benzyl-10-methyl-N-(2-morpholin-4-ylethyl)-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide.
Chemical Property Profile of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Property Insights of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide. Following Lipinski's Rule of Five, 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide 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 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide?
The CAS number of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide is 896846-63-2.
What is the molecular formula of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide?
The molecular formula of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide is C25H27N5O3.
What is the molecular weight of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide?
The molecular weight of 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide is 445.21 g/mol.
Where can I buy 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide?
You can request a quote for 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-9-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.