![2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one structure](/static/products/3711/371129-67-8.webp)
2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one
TL;DR: 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one (CAS 371129-67-8) is a chemical compound with molecular formula C24H19N5O3S and molecular weight 457.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(benzenesulfonyl)-6-imino-11-methyl-7-(pyridin-4-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one, 5-(benzenesulfonyl)-6-imino-11-methyl-7-[(pyridin-4-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaen-2-one, 2-imino-10-methyl-3-(phenylsulfonyl)-1-(4-pyridylmethyl)-1,6-dihydropyridino[2 ,3-d]pyridino[1,2-a]pyrimidin-5-one, 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
| Molecular Formula | C24H19N5O3S |
|---|---|
| Molecular Weight | 457.12 g/mol |
| LogP | 2.71319 |
| Topological Polar Surface Area | 110.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.12085 |
| Heavy Atoms | 33 |
| Complexity | 1742.8461 |
Chemical Identifiers
| CAS Number | 371129-67-8 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CC4=CC=NC=C4)S(=O)(=O)C5=CC=CC=C5 |
Product Overview
2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one (CAS 371129-67-8), with molecular formula C24H19N5O3S and molecular weight 457.12 g/mol. IUPAC: 5-(benzenesulfonyl)-6-imino-11-methyl-7-(pyridin-4-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
Chemical Property Profile of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one
Property Insights of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one
The XLogP value of 2.71319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one. The TPSA of 110.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one. Following Lipinski's Rule of Five, 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one has 1 hydrogen bond donor(s) and 6 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 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one?
The CAS number of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one is 371129-67-8.
What is the molecular formula of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one?
The molecular formula of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one is C24H19N5O3S.
What is the molecular weight of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one?
The molecular weight of 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one is 457.12 g/mol.
Where can I buy 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one?
You can request a quote for 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-imino-10-methyl-3-(phenylsulfonyl)-1-(pyridin-4-ylmethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.