Substituted Cyclic Urea 26
TL;DR: Substituted Cyclic Urea 26 (CAS 167826-76-8) is a chemical compound with molecular formula C27H38N2O3 and molecular weight 438.28824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R,5S,6S,7R)-1,3-dibenzyl-5,6-dihydroxy-4,7-bis(2-methylpropyl)-1,3-diazepan-2-one
Also Known As: Substituted Cyclic Urea 26, 5,6-Dihydroxy-1,3-Diazepin-2-one analog, (4R,5S,6S,7R)-1,3-dibenzyl-5,6-dihydroxy-4,7-bis(2-methylpropyl)-1,3-diazepan-2-one, (4R,5S,6S,7R)-1,3-dibenzyl-5,6-dihydroxy-4,7-diisobutyl-1,3-diazepan-2-one, (4R)-1,3-Dibenzyl-4alpha,7beta-diisobutyl-5alpha,6beta-dihydroxy-4,5,6,7-tetrahydro-1H-1,3-diazepine-2(3H)-one
Technical Specifications
| Molecular Formula | C27H38N2O3 |
| Molecular Weight | 438.28824 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 64.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 438.28824 Da |
| Heavy Atoms | 32 |
| Complexity | 521.0 |
| SMILES | CC(C)C[C@@H]1[C@@H]([C@H]([C@H](N(C(=O)N1CC2=CC=CC=C2)CC3=CC=CC=C3)CC(C)C)O)O |
| InChIKey | RCNUENIVKDGSSE-XPGKHFPBSA-N |
Chemical Property Profile of Substituted Cyclic Urea 26
Property Insights of Substituted Cyclic Urea 26
The XLogP value of 4.8 indicates that Substituted Cyclic Urea 26 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Substituted Cyclic Urea 26. Following Lipinski's Rule of Five, Substituted Cyclic Urea 26 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Substituted Cyclic Urea 26?
The CAS number of Substituted Cyclic Urea 26 is 167826-76-8.
What is the molecular formula of Substituted Cyclic Urea 26?
The molecular formula of Substituted Cyclic Urea 26 is C27H38N2O3.
What is the molecular weight of Substituted Cyclic Urea 26?
The molecular weight of Substituted Cyclic Urea 26 is 438.28824 g/mol.
Where can I buy Substituted Cyclic Urea 26?
You can request a quote for Substituted Cyclic Urea 26 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Substituted Cyclic Urea 26?
Yes, CoreyChem provides custom synthesis services for Substituted Cyclic Urea 26 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.