Substituted Cyclic Urea 32
TL;DR: Substituted Cyclic Urea 32 (CAS 177283-87-3) is a chemical compound with molecular formula C29H30N2O5 and molecular weight 486.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis(furan-3-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one
Also Known As: Substituted Cyclic Urea 32, 1,3-Diazepin-2-one deriv., XV 076, (4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis(furan-3-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one, 2H-1,3-Diazepin-2-one, 4,7-bis(3-furanylmethyl)hexahydro-5,6-dihydroxy-1,3-bis(phenylmethyl)-, (4R,5S,6S,7R)-
| Molecular Formula | C29H30N2O5 |
|---|---|
| Molecular Weight | 486.22 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 486.21548 |
| Heavy Atoms | 36 |
| Complexity | 639.0 |
Chemical Identifiers
| CAS Number | 177283-87-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2[C@@H]([C@@H]([C@H]([C@H](N(C2=O)CC3=CC=CC=C3)CC4=COC=C4)O)O)CC5=COC=C5 |
| InChIKey | QCZIGGBDUSMTIJ-VIJSPRBVSA-N |
Product Overview
Substituted Cyclic Urea 32 (CAS 177283-87-3), with molecular formula C29H30N2O5 and molecular weight 486.22 g/mol. IUPAC: (4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis(furan-3-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one.
Chemical Property Profile of Substituted Cyclic Urea 32
Property Insights of Substituted Cyclic Urea 32
The XLogP value of 3.4 indicates that Substituted Cyclic Urea 32 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Substituted Cyclic Urea 32. Following Lipinski's Rule of Five, Substituted Cyclic Urea 32 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 Substituted Cyclic Urea 32?
The CAS number of Substituted Cyclic Urea 32 is 177283-87-3.
What is the molecular formula of Substituted Cyclic Urea 32?
The molecular formula of Substituted Cyclic Urea 32 is C29H30N2O5.
What is the molecular weight of Substituted Cyclic Urea 32?
The molecular weight of Substituted Cyclic Urea 32 is 486.22 g/mol.
Where can I buy Substituted Cyclic Urea 32?
You can request a quote for Substituted Cyclic Urea 32 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Substituted Cyclic Urea 32?
Yes, KEHONG BIO provides custom synthesis services for Substituted Cyclic Urea 32 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.