L 640035
(11,11-dioxobenzo[b][1]benzothiepin-2-yl)methanol
Also Known As: Dibenzo(b,f)thiepin-3-methanol, 5,5-dioxide|L 640035|3-Hydroxymethyldibenzo(b,f)thiepin 5,5-dioxide|Cid 127538|L-640035|(11,11-dioxobenzo[b][1]benzothiepin-2-yl)methanol|L-640,035|3-Hydroxymethyldibenzo[b,f]thiepin-5,5-dioxide|3-hydroxymethyl-dibenzo[b,f]thiepin-5,5-dioxide|L-640-035|3-(Hydroxymethyl)dibenzo[b,f]thiepine 5,5-dioxide|DIBENZO[B,F]THIEPIN-3-METHANOL,5,5-DIOXIDE|3-(HYDROXYMETHYL)DIBENZO(B,F)THIEPIN 5,5-DIOXIDE|3-(Hydroxymethyl)-5H-5lambda~6~-dibenzo[b,f]thiepine-5,5-dione
| Molecular Formula | C15H12O3S |
|---|---|
| Molecular Weight | 272.05072 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.05072 |
| Monoisotopic Mass | 272.05072 |
| Heavy Atoms | 19 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 815-66-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C(S2(=O)=O)C=C(C=C3)CO |
| InChIKey | NYFDVYBQHBRTNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
L 640035 (CAS 815-66-7), with molecular formula C15H12O3S and molecular weight 272.05072 g/mol. IUPAC: (11,11-dioxobenzo[b][1]benzothiepin-2-yl)methanol.
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