CAS RN: 1419949-20-4
NVP-TNKS656
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.20251217 | 1mg / 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1419949-20-4
- Purity/Analytical Methods: >99.0%
1419949-20-4 / N-(cyclopropylmethyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]-N-[(4-oxo-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-yl)methyl]acetamide
Basic Information
CAS
1419949-20-4
Multi CAS
No
Molecular Formula
C27H34N4O5
Molecular Weight
494.600000
Exact Mass
494.252920
SMILES
COC1=CC=C(C=C1)C(=O)C2CCN(CC2)CC(=O)N(CC3CC3)CC4=NC5=C(COCC5)C(=O)N4
InChI
InChI=1S/C27H34N4O5/c1-35-21-6-4-19(5-7-21)26(33)20-8-11-30(12-9-20)16-25(32)31(14-18-2-3-18)15-24-28-23-10-13-36-17-22(23)27(34)29-24/h4-7,18,20H,2-3,8-17H2,1H3,(H,28,29,34)
InChIKey
DYGBNAYFDZEYBA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Aromatic heavy atom count
12
Fraction Csp3
0.56
Rotatable bonds
9
H-bond acceptors
7
H-bond donors
1
Molar refractivity
132.85
TPSA
104.83
LogP / Solubility
WLOGP
2.18
MLOGP
1.96
XLogP3
1.1
Consensus LogP
1.75
Log S (ESOL)
-3.94
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.19
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
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
Customers Also Viewed
-
4-(4-methoxybenzoyl)-1-Piperidineacetic acid
- CAS RN: 1419957-49-5
- Product Code: starshine_CAS1419957-49-5
- Purity/Analytical method: >99.0%
-
-
4-Chloro-5-fluoro-1H-indazole
- CAS RN: 1420068-88-7
- Product Code: starshine_CAS1420068-88-7
- Purity/Analytical method: >99.0%
-
LAS191859
- CAS RN: 1420071-13-1
- Product Code: starshine_CAS1420071-13-1
- Purity/Analytical method: >99.0%
-
1H-Isoindole-1,3(2H)-dione, 5-[5-[[3-(4-broMophenyl)-2-iMino-4-oxo-5-thiazolidinylidene]Methyl]-2-furanyl]-
- CAS RN: 1420071-30-2
- Product Code: SSC-052698
-
![CAS 1420071-30-2 1H-Isoindole-1,3(2H)-dione, 5-[5-[[3-(4-broMophenyl)-2-iMino-4-oxo-5-thiazolidinylidene]Methyl]-2-furanyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1420071-30-2.gif)
