V014-2652 Screening compound: 1-[sec-butyl(3-methylbenzyl)amino]-3-isopropoxy-2-propanol

V014-2652 Screening compound: 1-[sec-butyl(3-methylbenzyl)amino]-3-isopropoxy-2-propanol
V014-2652 Screening compound: 1-[sec-butyl(3-methylbenzyl)amino]-3-isopropoxy-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-2652
1-[sec-butyl(3-methylbenzyl)amino]-3-isopropoxy-2-propanol

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

V014-2652

Molecular Formula

C18H31NO2 (C18 H31 NO2)

Compound Name

1-[sec-butyl(3-methylbenzyl)amino]-3-isopropoxy-2-propanol

IUPAC name

(butan-2-yl)[2-hydroxy-3-(propan-2-yloxy)propyl][(3-methylphenyl)methyl]amine

SMILES

CCC(C)N(CC(COC(C)C)O)Cc1cc(C)ccc1

InChI

InChI=1S/C18H31NO2/c1-6-16(5)19(12-18(20)13-21-14(2)3)11-17-9-7-8-15(4)10-17/h7-10,14,16,18,20H,6,11-13H2,1-5H3

InChI Key

HZMSIAPMISUNOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19838760

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

293.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.876

Distribution Coefficient, logD

2.738

Water Solubility, LogSw

-3.82

Polar Surface Area

27.344

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

References: we are preparing a list of scientific research reports with V014-2652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-2652?
Check Price and Availability of V014-2652, 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 V014-2652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-2652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-2652
  • 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 V014-2652 available by request