ChemDiv3_007282
TL;DR: ChemDiv3_007282 (CAS 712346-69-5) is a chemical compound with molecular formula C16H20F6N2O2 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazoline-2,5-dione
Also Known As: ChemDiv3_007282, IDI1_025192, BRD-K29084005-001-01-9, 1-butyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazoline-2,5-dione, 1-butyl-2-hydroxy-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
| Molecular Formula | C16H20F6N2O2 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 4.3183 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.14288 |
| Heavy Atoms | 26 |
| Complexity | 634.10583 |
Chemical Identifiers
| CAS Number | 712346-69-5 |
|---|---|
| SMILES | CCCCN1C2=C(C(=O)CC(C2)(C)C)C(NC1=O)(C(F)(F)F)C(F)(F)F |
Product Overview
ChemDiv3_007282 (CAS 712346-69-5), with molecular formula C16H20F6N2O2 and molecular weight 386.14 g/mol. IUPAC: 1-butyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazoline-2,5-dione.
Chemical Property Profile of ChemDiv3_007282
Property Insights of ChemDiv3_007282
The XLogP value of 4.3183 indicates that ChemDiv3_007282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, ChemDiv3_007282 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_007282 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 ChemDiv3_007282?
The CAS number of ChemDiv3_007282 is 712346-69-5.
What is the molecular formula of ChemDiv3_007282?
The molecular formula of ChemDiv3_007282 is C16H20F6N2O2.
What is the molecular weight of ChemDiv3_007282?
The molecular weight of ChemDiv3_007282 is 386.14 g/mol.
Where can I buy ChemDiv3_007282?
You can request a quote for ChemDiv3_007282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007282?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.