D751-0148 Screening compound: 2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]-N~1~-(3-pyridylmethyl)acetamide

D751-0148 Screening compound: 2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]-N~1~-(3-pyridylmethyl)acetamide
D751-0148 Screening compound: 2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]-N~1~-(3-pyridylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D751-0148
2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]-N~1~-(3-pyridylmethyl)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

D751-0148

Molecular Formula

C27H25N5O2 (C27 H25 N5 O2)

Compound Name

2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]-N~1~-(3-pyridylmethyl)acetamide

IUPAC name

2-[(1R)-21-methyl-14-oxo-31321-triazapentacyclo[11.8.0.0^{210}.0^{49}.0^{1520}]henicosa-2(10)4(9)5715(20)1618-heptaen-3-yl]-N-[(pyridin-3-yl)methyl]acetamide

SMILES

CN([C@@H]1N2CCc3c1n(CC(NCc1cnccc1)=O)c1c3cccc1)c(cccc1)c1C2=O

InChI

InChI=1S/C27H25N5O2/c1-30-22-10-4-3-9-21(22)27(34)31-14-12-20-19-8-2-5-11-23(19)32(25(20)26(30)31)17-24(33)29-16-18-7-6-13-28-15-18/h2-11,13,15,26H,12,14,16-17H2,1H3,(H,29,33)/t26-/m1/s1

InChI Key

VDSLPDZMOOPRQP-AREMUKBSSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.997

Distribution Coefficient, logD

2.994

Water Solubility, LogSw

-3.28

Polar Surface Area

52.495

Acid Dissociation Constant (pKa)

13.39

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.22

D751-0148 in Drug Discovery

Included in Screening Libraries

Natural-Product-Based Library (3730 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with D751-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D751-0148?
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What is the minimum amount of D751-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D751-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D751-0148
  • 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 D751-0148 available by request