![CAS 551909-15-0 Urea, N-(4-chlorophenyl)-N’-[2-(3-chlorophenyl)ethyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/551909-15-0.gif)
CAS RN: 551909-15-0
Urea, N-(4-chlorophenyl)-N’-[2-(3-chlorophenyl)ethyl]-
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260422 | 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS551909-15-0
- Purity/Analytical Methods: >99.0%
551909-15-0 / 1-(4-chlorophenyl)-3-[2-(3-chlorophenyl)ethyl]urea
Basic Information
CAS
551909-15-0
Multi CAS
No
Molecular Formula
C15H14CL2N2O
Molecular Weight
309.200000
Exact Mass
308.048319
InChI
InChI=1S/C15H14Cl2N2O/c16-12-4-6-14(7-5-12)19-15(20)18-9-8-11-2-1-3-13(17)10-11/h1-7,10H,8-9H2,(H2,18,19,20)
InChIKey
PPKIPROVSKBYAT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
4
H-bond acceptors
1
H-bond donors
2
Molar refractivity
83.63
TPSA
41.13
LogP / Solubility
WLOGP
4.36
MLOGP
3.85
XLogP3
4.1
Consensus LogP
4.1
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.77
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.51
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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