D658-0267 Screening compound: 1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of ChemDiv screening compound D658-0267
1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
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
D658-0267
Molecular Formula
C27H32N2O5 (C27 H32 N2 O5)
Compound Name
1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
IUPAC name
1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-1H2H3H9H-chromeno[23-c]pyrrole-39-dione
SMILES
CCCCOc(ccc(C(C1=C2Oc(cccc3)c3C1=O)N(CCCN(C)C)C2=O)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
464.56
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.960
Distribution Coefficient, logD
2.011
Water Solubility, LogSw
-3.98
Polar Surface Area
55.983
Acid Dissociation Constant (pKa)
18.11
Base Dissociation Constant (pKb)
9.34
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
40.70
D658-0267 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Cysteine Proteases Inhibitors Library (7839 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Nervous system
- Cardiovascular
- Skin
- Metabolic
- Endocrine
- Immune system
- Proteases
References: we are preparing a list of scientific research reports with D658-0267 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)