ChemDiv3_001006
TL;DR: ChemDiv3_001006 (CAS 328076-72-8) is a chemical compound with molecular formula C14H16N4O2S and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanylacetohydrazide
Also Known As: ChemDiv3_001006, IDI1_019972, 2-{[3-(2-Methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]thio}acetohydrazide, BAS 00539241, 2-[3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanylacetohydrazide
| Molecular Formula | C14H16N4O2S |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.0994 |
| Heavy Atoms | 21 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 328076-72-8 |
|---|---|
| SMILES | CC(=C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NN |
| InChIKey | WYRLJPLPIDXIAT-UHFFFAOYSA-N |
Product Overview
ChemDiv3_001006 (CAS 328076-72-8), with molecular formula C14H16N4O2S and molecular weight 304.10 g/mol. IUPAC: 2-[3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanylacetohydrazide.
Chemical Property Profile of ChemDiv3_001006
Property Insights of ChemDiv3_001006
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_001006. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_001006. Following Lipinski's Rule of Five, ChemDiv3_001006 has 2 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 ChemDiv3_001006?
The CAS number of ChemDiv3_001006 is 328076-72-8.
What is the molecular formula of ChemDiv3_001006?
The molecular formula of ChemDiv3_001006 is C14H16N4O2S.
What is the molecular weight of ChemDiv3_001006?
The molecular weight of ChemDiv3_001006 is 304.10 g/mol.
Where can I buy ChemDiv3_001006?
You can request a quote for ChemDiv3_001006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_001006?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_001006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.