TL;DR: DMPC Cyclic Urea 1 (CAS 152928-75-1) is a chemical compound with molecular formula C31H42N2O7 and molecular weight 554.2992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[(4R,5S,6S,7R)-4,7-dibenzyl-3-(5-carboxypentyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]hexanoic acid
Also Known As: DMPC Cyclic Urea 1, 1H-1,3-Diazepine-1,3(2H)-dihexanoic acid, tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-, (4R,5S,6S,7R)-, 6,6'-[(4R,5S,6S,7R)-4,7-Dibenzyl-5,6-dihydroxy-2-oxo-1,3-diazepane-1,3-diyl]dihexanoic acid, 6-[(4R,5S,6S,7R)-4,7-dibenzyl-3-(5-carboxypentyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]hexanoic acid, 6-[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-3-(6-hydroxy-6-oxo-hexyl)-2-oxo-1,3-diazepan-1-yl]hexanoic acid
| Molecular Formula | C31H42N2O7 |
| Molecular Weight | 554.2992 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 554.2992 Da |
| Heavy Atoms | 40 |
| Complexity | 720.0 |
| SMILES | C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCC(=O)O)CCCCCC(=O)O)CC3=CC=CC=C3)O)O |
| InChIKey | XGEGDSLAQZJGCW-HHGOQMMWSA-N |
The XLogP value of 3.5 indicates that DMPC Cyclic Urea 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DMPC Cyclic Urea 1. Following Lipinski's Rule of Five, DMPC Cyclic Urea 1 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of DMPC Cyclic Urea 1 is 152928-75-1.
The molecular formula of DMPC Cyclic Urea 1 is C31H42N2O7.
The molecular weight of DMPC Cyclic Urea 1 is 554.2992 g/mol.
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