TL;DR: CCRIS 6576 (CAS 150446-02-9) is a chemical compound with molecular formula C24H20ClN3O3 and molecular weight 433.11932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(1-benzyl-2-methyl-5-nitroindol-3-yl)-N-[(4-chlorophenyl)methoxy]methanimine
Also Known As: 2-Methyl-5-nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde, O-((4-chlorophenyl)methyl)oxime, 2-Methyl-5-nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde O-((4-chlorophenyl)methyl)oxime, 2-METHYL-5-NITRO-1-(PHENYLMETHYL)-1H-INDOLE-3-CARBOXALDEHYDE,O-((4-CHLOROPHENYL)METHYL)OXIME, CCRIS 6576
| Molecular Formula | C24H20ClN3O3 |
| Molecular Weight | 433.11932 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.11932 Da |
| Heavy Atoms | 31 |
| Complexity | 614.0 |
| SMILES | CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-])/C=N/OCC4=CC=C(C=C4)Cl |
| InChIKey | LWZLSZKOMYHDEM-VULFUBBASA-N |
The XLogP value of 6.0 indicates that CCRIS 6576 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for CCRIS 6576. Following Lipinski's Rule of Five, CCRIS 6576 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of CCRIS 6576 is 150446-02-9.
The molecular formula of CCRIS 6576 is C24H20ClN3O3.
The molecular weight of CCRIS 6576 is 433.11932 g/mol.
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