CAS RN: 55145-14-7
DACM
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.20251122 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS55145-14-7
- Purity/Analytical Methods: >99.0%
55145-14-7 / 1-[7-(dimethylamino)-4-methyl-2-oxochromen-3-yl]pyrrole-2,5-dione
Basic Information
CAS
55145-14-7
Multi CAS
Yes
Molecular Formula
C16H14N2O4
Molecular Weight
298.290000
Exact Mass
298.095357
InChI
InChI=1S/C16H14N2O4/c1-9-11-5-4-10(17(2)3)8-12(11)22-16(21)15(9)18-13(19)6-7-14(18)20/h4-8H,1-3H3
InChIKey
ADEORFBTPGKHRP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
10
Fraction Csp3
0.19
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
83.18
TPSA
70.83
LogP / Solubility
WLOGP
1.6
MLOGP
1.42
XLogP3
1.3
Consensus LogP
1.44
Log S (ESOL)
-2.9
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.16
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.16
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
Pirolate
- CAS RN: 55149-05-8
- Product Code: starshine_CAS55149-05-8
- Purity/Analytical method: >99.0%
-
2-AMINO-6,7-DIMETHOXY-QUINOLINE-3-CARBOXYLIC ACID AMIDE
- CAS RN: 55149-43-4
- Product Code: starshine_CAS55149-43-4
- Purity/Analytical method: >99.0%
-
7-NITRO-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBALDEHYDE
- CAS RN: 55149-81-0
- Product Code: SSC-162989
-
-
