TL;DR: DMPC Cyclic Urea 61 (CAS 152928-84-2) is a chemical compound with molecular formula C33H50N2O5 and molecular weight 554.37195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1,3-bis(7-hydroxyheptyl)-1,3-diazepan-2-one
Also Known As: DMPC Cyclic Urea 61, 2H-1,3-Diazepin-2-one, hexahydro-5,6-dihydroxy-1,3-bis(7-hydroxyheptyl)-4,7-bis(phenylmethyl)-, (4R,5S,6S,7R)-, (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1,3-bis(7-hydroxyheptyl)-1,3-diazepan-2-one
| Molecular Formula | C33H50N2O5 |
| Molecular Weight | 554.37195 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 554.37195 Da |
| Heavy Atoms | 40 |
| Complexity | 613.0 |
| SMILES | C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCCCO)CCCCCCCO)CC3=CC=CC=C3)O)O |
| InChIKey | ULBYZNDXPCBOLF-ZRTHHSRSSA-N |
The XLogP value of 4.9 indicates that DMPC Cyclic Urea 61 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DMPC Cyclic Urea 61. Following Lipinski's Rule of Five, DMPC Cyclic Urea 61 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of DMPC Cyclic Urea 61 is 152928-84-2.
The molecular formula of DMPC Cyclic Urea 61 is C33H50N2O5.
The molecular weight of DMPC Cyclic Urea 61 is 554.37195 g/mol.
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