6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone
TL;DR: 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone (CAS 74875-89-1) is a chemical compound with molecular formula C18H13N5O4S and molecular weight 395.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-nitro-4-oxoquinazolin-3-yl)methyl]-2-phenylimino-1,3-thiazolidin-4-one
Also Known As: 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 6-nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-, 3-[(6-nitro-4-oxoquinazolin-3-yl)methyl]-2-phenylimino-1,3-thiazolidin-4-one, 6-Nitro-3-[[4-oxo-2-(phenylimino)thiazolidin-3-yl]methyl]quinazolin-4(3H)-one, 6-nitro-3-{[4-oxo-2-(phenylimino)-1,3-thiazolidin-3-yl]methyl}-3,4-dihydroquinazolin-4-one
| Molecular Formula | C18H13N5O4S |
|---|---|
| Molecular Weight | 395.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.06882 |
| Heavy Atoms | 28 |
| Complexity | 715.0 |
Chemical Identifiers
| CAS Number | 74875-89-1 |
|---|---|
| SMILES | C1C(=O)N(C(=NC2=CC=CC=C2)S1)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-] |
| InChIKey | QYDWZKQEYGFWCQ-UHFFFAOYSA-N |
Product Overview
6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone (CAS 74875-89-1), with molecular formula C18H13N5O4S and molecular weight 395.07 g/mol. IUPAC: 3-[(6-nitro-4-oxoquinazolin-3-yl)methyl]-2-phenylimino-1,3-thiazolidin-4-one.
Chemical Property Profile of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone
Property Insights of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone. Following Lipinski's Rule of Five, 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 7 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 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone?
The CAS number of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone is 74875-89-1.
What is the molecular formula of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone?
The molecular formula of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone is C18H13N5O4S.
What is the molecular weight of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone?
The molecular weight of 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone is 395.07 g/mol.
Where can I buy 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone?
You can request a quote for 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-3-((4-oxo-2-phenylimino-3-thiazolidinyl)methyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.