TL;DR: C25H28N4O2 (CAS 552285-09-3) is a chemical compound with molecular formula C25H28N4O2 and molecular weight 416.22122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-[3-(4-tert-butylphenyl)-2-methylpropylidene]amino]-8-methoxy-5H-pyrimido[5,4-b]indol-4-one
Also Known As: (E)-3-((3-(4-(tert-butyl)phenyl)-2-methylpropylidene)amino)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-{[(1E)-3-(4-tert-butylphenyl)-2-methylpropylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C25H28N4O2 |
| Molecular Weight | 416.22122 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.22122 Da |
| Heavy Atoms | 31 |
| Complexity | 692.0 |
| SMILES | CC(CC1=CC=C(C=C1)C(C)(C)C)/C=N/N2C=NC3=C(C2=O)NC4=C3C=C(C=C4)OC |
| InChIKey | UCXWKCOYRLZGAS-MZJWZYIUSA-N |
The XLogP value of 5.4 indicates that C25H28N4O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H28N4O2. Following Lipinski's Rule of Five, C25H28N4O2 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of C25H28N4O2 is 552285-09-3.
The molecular formula of C25H28N4O2 is C25H28N4O2.
The molecular weight of C25H28N4O2 is 416.22122 g/mol.
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