P435-1036 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}propanoate

P435-1036 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}propanoate
P435-1036 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P435-1036
methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}propanoate

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

P435-1036

Molecular Formula

C17H26N4O5 (C17 H26 N4 O5)

Compound Name

methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}propanoate

IUPAC name

methyl 2-({4-[4-(dimethylcarbamoyl)-5-methyl-13-oxazol-2-yl]piperidine-1-carbonyl}amino)propanoate

SMILES

CC(C(OC)=O)NC(N(CC1)CCC1c1nc(C(N(C)C)=O)c(C)o1)=O

InChI

InChI=1S/C17H26N4O5/c1-10(16(23)25-5)18-17(24)21-8-6-12(7-9-21)14-19-13(11(2)26-14)15(22)20(3)4/h10,12H,6-9H2,1-5H3,(H,18,24)/t10-/m0/s1

InChI Key

CKOPRBZOHRXITK-JTQLQIEISA-N

MDL Number (MFCD)

MFCD27575306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.449

Distribution Coefficient, logD

0.449

Water Solubility, LogSw

-1.30

Polar Surface Area

81.266

Acid Dissociation Constant (pKa)

15.28

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.71

P435-1036 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P435-1036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P435-1036?
Check Price and Availability of P435-1036, 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 P435-1036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P435-1036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P435-1036
  • 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 P435-1036 available by request