4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione
TL;DR: 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione (CAS 477848-86-5) is a chemical compound with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-6,7-dimethoxy-3-(thiophen-2-ylmethyl)quinazoline-2-thione
Also Known As: 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione, 4-amino-6,7-dimethoxy-3-(thiophen-2-ylmethyl)quinazoline-2-thione, 4-imino-6,7-dimethoxy-3-[(thiophen-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2-thione
| Molecular Formula | C15H15N3O2S2 |
|---|---|
| Molecular Weight | 333.06 g/mol |
| LogP | 3.47499 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.06058 |
| Heavy Atoms | 22 |
| Complexity | 872.61523 |
Chemical Identifiers
| CAS Number | 477848-86-5 |
|---|---|
| SMILES | COC1=CC2=C(N(C(=S)N=C2C=C1OC)CC3=CC=CS3)N |
Product Overview
4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione (CAS 477848-86-5), with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol. IUPAC: 4-amino-6,7-dimethoxy-3-(thiophen-2-ylmethyl)quinazoline-2-thione.
Chemical Property Profile of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione
Property Insights of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione
The XLogP value of 3.47499 indicates that 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione. Following Lipinski's Rule of Five, 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione 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 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione?
The CAS number of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione is 477848-86-5.
What is the molecular formula of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione?
The molecular formula of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione is C15H15N3O2S2.
What is the molecular weight of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione?
The molecular weight of 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione is 333.06 g/mol.
Where can I buy 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione?
You can request a quote for 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione?
Yes, KEHONG BIO provides custom synthesis services for 4-imino-6,7-dimethoxy-3-(2-thienylmethyl)-3,4-dihydro-2(1H)-quinazolinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.