C28H22ClNO6
TL;DR: C28H22ClNO6 (CAS 1039757-77-1) is a chemical compound with molecular formula C28H22ClNO6 and molecular weight 503.11356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8-chloro-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-phenyl-2-(phenylmethoxycarbonylamino)acetate
Also Known As: 8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-2-phenylacetate, (8-chloro-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-phenyl-2-(phenylmethoxycarbonylamino)acetate, 8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl {[(benzyloxy)carbonyl]amino}(phenyl)acetate, C28H22ClNO6
Technical Specifications
| Molecular Formula | C28H22ClNO6 |
| Molecular Weight | 503.11356 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.11356 Da |
| Heavy Atoms | 36 |
| Complexity | 862.0 |
| SMILES | C1CC2=C(C1)C(=O)OC3=CC(=C(C=C23)Cl)OC(=O)C(C4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5 |
| InChIKey | KPEHSQQMFHGTEC-UHFFFAOYSA-N |
Chemical Property Profile of C28H22ClNO6
Property Insights of C28H22ClNO6
The XLogP value of 5.6 indicates that C28H22ClNO6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H22ClNO6. Following Lipinski's Rule of Five, C28H22ClNO6 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C28H22ClNO6?
The CAS number of C28H22ClNO6 is 1039757-77-1.
What is the molecular formula of C28H22ClNO6?
The molecular formula of C28H22ClNO6 is C28H22ClNO6.
What is the molecular weight of C28H22ClNO6?
The molecular weight of C28H22ClNO6 is 503.11356 g/mol.
Where can I buy C28H22ClNO6?
You can request a quote for C28H22ClNO6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C28H22ClNO6?
Yes, CoreyChem provides custom synthesis services for C28H22ClNO6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.