RefChem:473559
TL;DR: RefChem:473559 (CAS 371137-97-2) is a chemical compound with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(benzenesulfonyl)-6-imino-7-(2-methoxyethyl)-11-methyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: BAS 06260988, 2-Imino-1-(2-methoxyethyl)-10-methyl-3-(phenylsulfonyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one, 2-IMINO-1-(2-METHOXYETHYL)-10-METHYL-3-(PHENYLSULFONYL)-1,2-DIHYDRO-5H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-5-ONE, 2-Imino-1-(2-methoxyethyl)-10-methyl-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido(1,2-A:2,3-D)pyrimidin-5-one, 2-imino-1-(2-methoxyethyl)-10-methyl-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
| Molecular Formula | C21H20N4O4S |
|---|---|
| Molecular Weight | 424.12 g/mol |
| LogP | 1.91629 |
| Topological Polar Surface Area | 106.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.1205 |
| Heavy Atoms | 30 |
| Complexity | 1489.2554 |
Chemical Identifiers
| CAS Number | 371137-97-2 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCOC)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
RefChem:473559 (CAS 371137-97-2), with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol. IUPAC: 5-(benzenesulfonyl)-6-imino-7-(2-methoxyethyl)-11-methyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
Chemical Property Profile of RefChem:473559
Property Insights of RefChem:473559
The XLogP value of 1.91629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:473559. The TPSA of 106.52 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:473559. Following Lipinski's Rule of Five, RefChem:473559 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 RefChem:473559?
The CAS number of RefChem:473559 is 371137-97-2.
What is the molecular formula of RefChem:473559?
The molecular formula of RefChem:473559 is C21H20N4O4S.
What is the molecular weight of RefChem:473559?
The molecular weight of RefChem:473559 is 424.12 g/mol.
Where can I buy RefChem:473559?
You can request a quote for RefChem:473559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:473559?
Yes, KEHONG BIO provides custom synthesis services for RefChem:473559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.