CAS RN: 163515-14-8
DIMETHENAMID-P
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.20250314 | 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS163515-14-8
- Purity/Analytical Methods: >99.0%
163515-14-8 / 2-chloro-N-(2,4-dimethylthiophen-3-yl)-N-[(2S)-1-methoxypropan-2-yl]acetamide
Basic Information
CAS
163515-14-8
Multi CAS
No
Molecular Formula
C12H18ClNO2S
Molecular Weight
275.800000
Exact Mass
275.074678
SMILES
CC1=CSC(=C1N([C@@H](C)COC)C(=O)CCl)C
InChI
InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/t9-/m0/s1
InChIKey
JLYFCTQDENRSOL-VIFPVBQESA-N
Physical Properties
Boiling Point
>= 280 °C
BP: 122.6 °C at 0.07 mm Hg
Density
1.195 at 25 °C
Physical Description
Yellow to dark-brown liquid with a faintly aromatic odor; [ACGIH TLVs and BEIs]
Appearance
Faintly yellow viscous liquid
Yellow-brown, clear liquid
Dark brown liquid
State
Liquid
Storage Conditions
Keep container tightly closed in a dry and well-ventilated place. Containers which are opened must be carefully resealed and kept upright to prevent leakage. Recommended storage temperature 2 - 8 °C
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
5
Fraction Csp3
0.58
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
73.34
TPSA
29.54
LogP / Solubility
WLOGP
2.97
MLOGP
2.62
XLogP3
2.6
Consensus LogP
2.73
Log S (ESOL)
-3.31
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.97
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
Safety & Transport
Pictogram(s)
Irritant
Environmental Hazard
Acute Toxic
Health Hazard
Signal
Warning
Danger
GHS Hazard Statements
H302: Harmful if swallowed [Warning Acute toxicity, oral]
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P391, and P501
P233, P260, P261, P264, P270, P271, P272, P273, P280, P284, P301+P317, P302+P352, P304+P340, P316, P321, P330, P333+P317, P342+P316, P362+P364, P391, P403, P403+P233, P405, and P501
P260, P264, P270, P273, P308+P316, P319, P391, P405, and P501
P233, P260, P261, P264, P270, P271, P273, P284, P301+P317, P304+P340, P316, P321, P330, P342+P316, P391, P403, P403+P233, P405, and P501
Customers Also Viewed
-
VILAZODONE
- CAS RN: 163521-12-8
- Product Code: starshine_CAS163521-12-8
- Purity/Analytical method: >99.0%
-
-
Cyclobutanecarboxylic acid, 1-[[(1,1-diMethylethoxy)carbonyl]aMino]-, ethyl ester
- CAS RN: 163554-54-9
- Product Code: starshine_CAS163554-54-9
- Purity/Analytical method: >99.0%
-
Carbamic acid, (1-formylcyclobutyl)-, 1,1-dimethylethyl ester (9CI)
- CAS RN: 163554-55-0
- Product Code: SSC-071046
-
METHYL 3,5-DIFORMYL-1-INDOLIZINECARBOXYLATE
- CAS RN: 163556-04-5
- Product Code: starshine_CAS163556-04-5
- Purity/Analytical method: >99.0%
-
![CAS 163554-54-9 Cyclobutanecarboxylic acid, 1-[[(1,1-diMethylethoxy)carbonyl]aMino]-, ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/163554-54-9.gif)
