C142-0300 Screening compound: 3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

C142-0300 Screening compound: 3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
C142-0300 Screening compound: 3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C142-0300
3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

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

C142-0300

Molecular Formula

C28H35NO7 (C28 H35 NO7)

Compound Name

3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

IUPAC name

3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-27-dimethyl-5-oxo-145678-hexahydroquinoline-36-dicarboxylate

SMILES

CC(CC1=C2C(c(cc3)cc(OC)c3O)C(C(OC3CCCCCC3)=O)=C(C)N1)C(C(OC)=O)C2=O

InChI

InChI=1S/C28H35NO7/c1-15-13-19-25(26(31)22(15)27(32)35-4)24(17-11-12-20(30)21(14-17)34-3)23(16(2)29-19)28(33)36-18-9-7-5-6-8-10-18/h11-12,14-15,18,22,24,29-30H,5-10,13H2,1-4H3

InChI Key

JHOZIYWWANHHPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05031598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.608

Distribution Coefficient, logD

0.774

Water Solubility, LogSw

-4.12

Polar Surface Area

89.587

Acid Dissociation Constant (pKa)

3.57

Base Dissociation Constant (pKb)

-3.74

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

53.60

C142-0300 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C142-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C142-0300?
Check Price and Availability of C142-0300, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C142-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C142-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C142-0300
  • 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 C142-0300 available by request