1770-0370 Screening compound: 10-[4-(tert-butyl)benzyl]-7,8-dimethyl-2,3,4,10-tetrahydropyrimido[1,2-a][1,3]benzimidazole

1770-0370 Screening compound: 10-[4-(tert-butyl)benzyl]-7,8-dimethyl-2,3,4,10-tetrahydropyrimido[1,2-a][1,3]benzimidazole
1770-0370 Screening compound: 10-[4-(tert-butyl)benzyl]-7,8-dimethyl-2,3,4,10-tetrahydropyrimido[1,2-a][1,3]benzimidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 1770-0370
10-[4-(tert-butyl)benzyl]-7,8-dimethyl-2,3,4,10-tetrahydropyrimido[1,2-a][1,3]benzimidazole

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

1770-0370

Molecular Formula

C23H29N3 (C23 H29 N3)

Compound Name

10-[4-(tert-butyl)benzyl]-7,8-dimethyl-2,3,4,10-tetrahydropyrimido[1,2-a][1,3]benzimidazole

IUPAC name

8-[(4-tert-butylphenyl)methyl]-45-dimethyl-1810-triazatricyclo[7.4.0.0^{27}]trideca-2(7)359-tetraene

SMILES

CC(C)(C)c1ccc(CN2C3=NCCCN3c3c2cc(C)c(C)c3)cc1

InChI

InChI=1S/C23H29N3/c1-16-13-20-21(14-17(16)2)26(22-24-11-6-12-25(20)22)15-18-7-9-19(10-8-18)23(3,4)5/h7-10,13-14H,6,11-12,15H2,1-5H3

InChI Key

VADPHRZISWPTFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01238956

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

347.5

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.568

Distribution Coefficient, logD

1.544

Water Solubility, LogSw

-5.76

Polar Surface Area

15.486

Acid Dissociation Constant (pKa)

27.49

Base Dissociation Constant (pKb)

12.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

1770-0370 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1770-0370 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1770-0370?
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What is the minimum amount of 1770-0370 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1770-0370
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1770-0370
  • 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 1770-0370 available by request