AC1MGQ2F structure

AC1MGQ2F

3-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione

Also Known As: ChemDiv3_004610|IDI1_022520|3-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione|AL-281/41584929|BRD-A78663163-001-01-0|3-[2-(1,3-BENZOTHIAZOL-2-YLSULFANYL)ACETYL]-3,8,8-TRIMETHYL-2,7-DIOXASPIRO[4.4]NONANE-1,6-DIONE|3-(2-(benzo[d]thiazol-2-ylthio)acetyl)-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione|3-[2-(Benzothiazol-2-ylsulfanyl)-acetyl]-3,8,8-trimethyl-2,7-dioxa-spiro[4.4]nonane-1,6-dione|7-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,7-trimethyl-3,8-dioxaspiro[4.4]nonane-4,9-dione

CAS: 692279-96-2
Molecular Formula C19H19NO5S2
Molecular Weight 405.07047 g/mol
LogP 3.375
Topological Polar Surface Area 82.56 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 4
Exact Mass 405.07047
Monoisotopic Mass 405.07047
Heavy Atoms 27
Complexity 934.91565

Chemical Identifiers

CAS Number 692279-96-2
SMILES CC1(CC2(CC(OC2=O)(C)C(=O)CSC3=NC4=CC=CC=C4S3)C(=O)O1)C

Product Overview

AC1MGQ2F (CAS 692279-96-2), with molecular formula C19H19NO5S2 and molecular weight 405.07047 g/mol. IUPAC: 3-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione.

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