TL;DR: N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide (CAS 148807-14-1) is a chemical compound with molecular formula C22H30N4O4 and molecular weight 414.2267 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N'-bis(1-methyl-6-oxo-3-pyridinyl)decanediamide
Also Known As: I4-BT8MeDNH2, 1-cyclohexyl-3-(4-methoxyphenyl)urea, N,N'-bis(1-methyl-6-oxopyridin-3-yl)decanediamide, N,N'-Bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide, N,N/'-Bis(1-methyl-6-oxopyridin-3-yl)decanediamide
| Molecular Formula | C22H30N4O4 |
| Molecular Weight | 414.2267 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 414.2267 Da |
| Heavy Atoms | 30 |
| Complexity | 729.0 |
| SMILES | CN1C=C(C=CC1=O)NC(=O)CCCCCCCCC(=O)NC2=CN(C(=O)C=C2)C |
| InChIKey | WLGABTVEZHOVSB-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide. Following Lipinski's Rule of Five, N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide is 148807-14-1.
The molecular formula of N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide is C22H30N4O4.
The molecular weight of N,N'-bis(2-(2-thiazolinyl))-1,8-octamethylenedicarboxamide is 414.2267 g/mol.
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