2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one
-
![2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3758a9be12be4ddc86f73a803e9b7291.png "2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one")
2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one
structure -
-
CAS No:
374087-14-6
-
Formula:
C25H26ClN5O2S2
-
Chemical Name:
2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one
-
Synonyms:
2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(E)-{[3-(morpholin-4-yl)propyl]imino}methyl]-1,2-dihydro-3H-pyrazol-3-one;ChemDiv1_006141;HMS604H03;ZINC2282760;STK150092;AKOS005406232;ZINC100401902;ZINC100401904;ZINC104258194;MCULE-5304304314;MCULE-7119561202;EU-0086164;SR-01000455610;SR-01000455610-1;(4E)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)thio]methyl}-4-{[(3-morpholin-4-ylpropyl)amino]methylene}-2,4-dihydro-3H-pyrazol-3-one;2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[(3-morpholinopropyl)imino]methyl}-1,2-dihydro-3H-pyrazol-3-one;374087-14-6
-
CAS No:
2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-(3-morpholin-4-ylpropyliminomethyl)-1H-pyrazol-3-one Basic Attributes
528.1 g/mol
527.1216451 g/mol
Computed Properties
Molecular Weight:528.1
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:527.1216451
Monoisotopic Mass:527.1216451
Topological Polar Surface Area:124
Heavy Atom Count:35
Complexity:786
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation