L794-0042 Screening compound: N-cyclopentyl-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L794-0042
N-cyclopentyl-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
L794-0042
Molecular Formula
C20H25N3O3S (C20 H25 N3 O3 S)
Compound Name
N-cyclopentyl-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
IUPAC name
N-cyclopentyl-1-(3-oxo-34-dihydro-2H-14-benzothiazine-2-carbonyl)piperidine-4-carboxamide
SMILES
O=C(C(CC1)CCN1C(C1Sc(cccc2)c2NC1=O)=O)NC1CCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.5
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.841
Distribution Coefficient, logD
1.841
Water Solubility, LogSw
-2.30
Polar Surface Area
66.269
Acid Dissociation Constant (pKa)
12.87
Base Dissociation Constant (pKb)
1.33
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
55.00
L794-0042 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Antiviral Library (67538 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- 3D
- Antiviral
- Infections
- Immune system
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with L794-0042 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of L794-0042, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)