L675-0304 Screening compound: N-[(3-methoxyphenyl)methyl]-9-phenyl-1,4-diazaspiro[5.5]undec-4-en-5-amine
Chemical Structure Depiction of ChemDiv screening compound L675-0304
N-[(3-methoxyphenyl)methyl]-9-phenyl-1,4-diazaspiro[5.5]undec-4-en-5-amine
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
L675-0304
Molecular Formula
C23H29N3O (C23 H29 N3 O)
Compound Name
N-[(3-methoxyphenyl)methyl]-9-phenyl-1,4-diazaspiro[5.5]undec-4-en-5-amine
IUPAC name
N-[(3-methoxyphenyl)methyl]-9-phenyl-14-diazaspiro[5.5]undec-4-en-5-amine
SMILES
COc1cc(CNC2=NCCNC2(CC2)CCC2c2ccccc2)ccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HCl
Molecular Weight
363.5
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.426
Distribution Coefficient, logD
2.367
Water Solubility, LogSw
-4.26
Polar Surface Area
40.119
Acid Dissociation Constant (pKa)
14.39
Base Dissociation Constant (pKb)
9.46
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
43.50
L675-0304 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS BBB Library (22607 compounds)
KRAS-Targeted Library (16000 compounds)
Protein-Protein Interaction Library (218420 compounds)
Spiro Library (21655 compounds)
Targeted Diversity Library (40567 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Cardiovascular
- Kinases
- Ion Channels
- PPI modulators
- PPI modulators
- Cyclic compounds
- Cyclic compounds
References: we are preparing a list of scientific research reports with L675-0304 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)