N121-0928 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-methyl-N~1~-(3-pyridylmethyl)butanamide

N121-0928 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-methyl-N~1~-(3-pyridylmethyl)butanamide
N121-0928 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-methyl-N~1~-(3-pyridylmethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound N121-0928
4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-methyl-N~1~-(3-pyridylmethyl)butanamide

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

N121-0928

Molecular Formula

C29H38N4O2 (C29 H38 N4 O2)

Compound Name

4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-methyl-N~1~-(3-pyridylmethyl)butanamide

IUPAC name

4-[(5R6R9S13S)-7-benzoyl-17-diazatricyclo[7.3.1.0^{513}]tridecan-6-yl]-N-methyl-N-[(pyridin-3-yl)methyl]butanamide

SMILES

CN(Cc1cnccc1)C(CCC[C@H]([C@@H]1[C@H]([C@@H](CCC2)C3)N2CCC1)N3C(c1ccccc1)=O)=O

InChI

InChI=1S/C29H38N4O2/c1-31(20-22-9-6-16-30-19-22)27(34)15-5-14-26-25-13-8-18-32-17-7-12-24(28(25)32)21-33(26)29(35)23-10-3-2-4-11-23/h2-4,6,9-11,16,19,24-26,28H,5,7-8,12-15,17-18,20-21H2,1H3/t24-,25-,26-,28-/m1/s1

InChI Key

LDVOOBIGKTZFHE-IYUNARRTSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.495

Distribution Coefficient, logD

0.033

Water Solubility, LogSw

-2.06

Polar Surface Area

44.334

Acid Dissociation Constant (pKa)

23.31

Base Dissociation Constant (pKb)

9.86

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

55.17

References: we are preparing a list of scientific research reports with N121-0928 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N121-0928?
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What is the minimum amount of N121-0928 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N121-0928
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N121-0928
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of N121-0928 available by request