Semotiadil

(2R)-2-[2-[3-[2-(1,3-benzodioxol-5-yloxy)ethyl-methylamino]propoxy]-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one

CAS: 116476-13-2

Molecular Formula	`C29H32N2O6S`
Molecular Weight	536.6 g/mol
LogP	5.1
Topological Polar Surface Area	95.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	11
Exact Mass	536.1981
Heavy Atoms	38
Complexity	761.0

Chemical Identifiers

CAS Number	116476-13-2
SMILES	`CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCN(C)CCOC4=CC5=C(C=C4)OCO5`
InChIKey	`RKXVEXUAWGRFNP-MUUNZHRXSA-N`

📖 Product Overview

Semotiadil (CAS: 116476-13-2) is a chemical compound with molecular formula C29H32N2O6S and molecular weight 536.6 g/mol. Its IUPAC systematic name is (2R)-2-[2-[3-[2-(1,3-benzodioxol-5-yloxy)ethyl-methylamino]propoxy]-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one. LogP 5.1 Topological Polar Surface Area 95.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 11 Exact Mass 536.1981 Heavy Atoms 38 Complexity 761.0 InChI Key: RKXVEXUAWGRFNP-MUUNZHRXSA-N. SMILES: CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCN(C)CCOC4=CC5=C(C=C4)OCO5.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Frequently Asked Questions

What is the typical lead time for this product?

Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.

Can you provide samples for testing?

Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

Do you ship internationally?

Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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