CAS RN: 1802929-43-6
PRN-1371
Product Availability
Choose a grade to view its available package options.
5 package records2 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260211 | 1mg / 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1802929-43-6
- Purity/Analytical Methods: >99.0%
1802929-43-6 / 6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)-8-[3-(4-prop-2-enoylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidin-7-one
Basic Information
CAS
1802929-43-6
Multi CAS
No
Molecular Formula
C26H30Cl2N6O4
Molecular Weight
561.500000
Exact Mass
560.170559
SMILES
CNC1=NC=C2C=C(C(=O)N(C2=N1)CCCN3CCN(CC3)C(=O)C=C)C4=C(C(=CC(=C4Cl)OC)OC)Cl
InChI
InChI=1S/C26H30Cl2N6O4/c1-5-20(35)33-11-9-32(10-12-33)7-6-8-34-24-16(15-30-26(29-2)31-24)13-17(25(34)36)21-22(27)18(37-3)14-19(38-4)23(21)28/h5,13-15H,1,6-12H2,2-4H3,(H,29,30,31)
InChIKey
PUIXMSRTTHLNKI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
38
Aromatic heavy atom count
16
Fraction Csp3
0.38
Rotatable bonds
9
H-bond acceptors
9
H-bond donors
1
Molar refractivity
149.74
TPSA
101.82
LogP / Solubility
WLOGP
3.54
MLOGP
3.16
XLogP3
3.5
Consensus LogP
3.4
Log S (ESOL)
-5.27
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.72
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.33
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5
Customers Also Viewed
-
GNE-140 (racemate)
- CAS RN: 1802977-61-2
- Product Code: starshine_CAS1802977-61-2
- Purity/Analytical method: >99.0%
-
Methyltetrazine-propylamine HCl salt
- CAS RN: 1802978-47-7
- Product Code: starshine_CAS1802978-47-7
- Purity/Analytical method: >99.0%
-
2-Propenoic acid, 2-methyl-, 6-[4-[2-(4-butylphenyl)diazenyl]phenoxy]hexyl ester
- CAS RN: 1802983-27-2
- Product Code: starshine_CAS1802983-27-2
- Purity/Analytical method: >99.0%
-
1H-Pyrazole-5-carboxylic acid, 1-[(2S)-3-(4-chlorophenoxy)-2-hydroxypropyl]-3-(4-methoxyphenyl)-, ethyl ester
- CAS RN: 1802997-81-4
- Product Code: starshine_CAS1802997-81-4
- Purity/Analytical method: >99.0%
-
N-[4-[[4-(1-Methylethyl)-1-piperazinyl]sulfonyl]phenyl]-2-nitro-4-(trifluoromethyl)benzamide hydrochloride
- CAS RN: 1803003-68-0
- Product Code: starshine_CAS1803003-68-0
- Purity/Analytical method: >99.0%
-
BLDAVCZELRQXFP-OWOJBTEDSA-N
- CAS RN: 1803026-58-5
- Product Code: starshine_CAS1803026-58-5
- Purity/Analytical method: >99.0%
![CAS 1802983-27-2 2-Propenoic acid, 2-methyl-, 6-[4-[2-(4-butylphenyl)diazenyl]phenoxy]hexyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1802983-27-2.gif)
![CAS 1802997-81-4 1H-Pyrazole-5-carboxylic acid, 1-[(2S)-3-(4-chlorophenoxy)-2-hydroxypropyl]-3-(4-methoxyphenyl)-, ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1802997-81-4.gif)
![CAS 1803003-68-0 N-[4-[[4-(1-Methylethyl)-1-piperazinyl]sulfonyl]phenyl]-2-nitro-4-(trifluoromethyl)benzamide hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1803003-68-0.gif)
