TL;DR: 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine (CAS 1321850-74-1) is a chemical compound with molecular formula C22H16ClNO4S and molecular weight 425.04886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine
Also Known As: (2Z)-3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)-2H-chromen-2-imine, 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine, F1601-0268, (Z)-3-chloro-4-methoxy-N-(3-(phenylsulfonyl)-2H-chromen-2-ylidene)aniline
| Molecular Formula | C22H16ClNO4S |
| Molecular Weight | 425.04886 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 73.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 425.04886 Da |
| Heavy Atoms | 29 |
| Complexity | 738.0 |
| SMILES | COC1=C(C=C(C=C1)N=C2C(=CC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4)Cl |
| InChIKey | ZTDOPZFCXGCOSO-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine. Following Lipinski's Rule of Five, 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine is 1321850-74-1.
The molecular formula of 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine is C22H16ClNO4S.
The molecular weight of 3-(benzenesulfonyl)-N-(3-chloro-4-methoxyphenyl)chromen-2-imine is 425.04886 g/mol.
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