P201-1305 Screening compound: 2-[1-(cyclopropylmethyl)-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl]-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound P201-1305
2-[1-(cyclopropylmethyl)-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl]-N-[(thiophen-2-yl)methyl]acetamide
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
P201-1305
Molecular Formula
C18H19N3O2S (C18 H19 N3 O2 S)
Compound Name
2-[1-(cyclopropylmethyl)-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl]-N-[(thiophen-2-yl)methyl]acetamide
IUPAC name
2-[1-(cyclopropylmethyl)-7-oxo-1H6H7H-pyrrolo[23-c]pyridin-6-yl]-N-[(thiophen-2-yl)methyl]acetamide
SMILES
O=C(CN(C=Cc1c2n(CC3CC3)cc1)C2=O)NCc1cccs1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
341.43
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.934
Distribution Coefficient, logD
1.934
Water Solubility, LogSw
-2.49
Polar Surface Area
43.671
Acid Dissociation Constant (pKa)
14.20
Base Dissociation Constant (pKb)
-0.94
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
P201-1305 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Bromodomain Modulators Library (5801 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Agro
- Agro
References: we are preparing a list of scientific research reports with P201-1305 chemical compound. It will be published here after verification.
Frequently Asked Questions
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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)