3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione
TL;DR: 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione (CAS 2473-93-0) is a chemical compound with molecular formula C14H15ClN2O2 and molecular weight 278.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione
Also Known As: 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione, cis-3-(3-Chlorophenyl)-perhydrocyclohexano[d]pyrimidin-2,4-dione
| Molecular Formula | C14H15ClN2O2 |
|---|---|
| Molecular Weight | 278.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.0822 |
| Heavy Atoms | 19 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 2473-93-0 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C(=O)N2)C3=CC(=CC=C3)Cl |
| InChIKey | IPWTYLKNSHGYOS-UHFFFAOYSA-N |
Product Overview
3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione (CAS 2473-93-0), with molecular formula C14H15ClN2O2 and molecular weight 278.08 g/mol. IUPAC: 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione.
Chemical Property Profile of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione
Property Insights of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione has 1 hydrogen bond donor(s) and 2 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 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione?
The CAS number of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione is 2473-93-0.
What is the molecular formula of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione?
The molecular formula of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione is C14H15ClN2O2.
What is the molecular weight of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione?
The molecular weight of 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione is 278.08 g/mol.
Where can I buy 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione?
You can request a quote for 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-chlorophenyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.