CAS RN: 7287-19-6
Prometryn
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250530 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251222 | 100g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250113 | 250g | In stock | Shanghai | Inquiry |
| Batchno.20250719 | 25g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251112 | 5g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: ICTB6186
- Purity/Analytical Methods: >98.0%(T)(HPLC)
7287-19-6 / 6-methylsulfanyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
Basic Information
CAS
7287-19-6
Multi CAS
No
Molecular Formula
C10H19N5S
Molecular Weight
241.360000
Exact Mass
241.136117
InChI
InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)
InChIKey
AAEVYOVXGOFMJO-UHFFFAOYSA-N
Physical Properties
Melting Point
119 °C
Density
1.157 g/cu cm at 20 °C
Physical Description
Prometryn appears as colorless crystals. Used as an herbicide.
Colorless or white odorless solid; [HSDB]
Appearance
Crystals
White powder
WHITE SOLID
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.7
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
2
Molar refractivity
69.13
TPSA
62.73
LogP / Solubility
WLOGP
2.23
MLOGP
1.97
XLogP3
3.5
Consensus LogP
2.57
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.15
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.68
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
