![CAS 1401987-20-9 Tert-Butyl 5-Oxo-7,8-Dihydroimidazo[1,5-C]Pyrimidine-6(5H)-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1401987-20-9(2).gif)
CAS RN: 1401987-20-9
Tert-Butyl 5-Oxo-7,8-Dihydroimidazo[1,5-C]Pyrimidine-6(5H)-Carboxylate
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.20251031 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1401987-20-9
- Purity/Analytical Methods: >99.0%
1401987-20-9 / tert-butyl 5-oxo-7,8-dihydroimidazo[1,5-c]pyrimidine-6-carboxylate
Basic Information
CAS
1401987-20-9
Multi CAS
No
Molecular Formula
C11H15N3O3
Molecular Weight
237.250000
Exact Mass
237.111341
SMILES
CC(C)(C)OC(=O)N1CCC2=CN=CN2C1=O
InChI
InChI=1S/C11H15N3O3/c1-11(2,3)17-10(16)13-5-4-8-6-12-7-14(8)9(13)15/h6-7H,4-5H2,1-3H3
InChIKey
HKIKWNQMRPTRCD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
5
Fraction Csp3
0.55
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
59.67
TPSA
64.43
LogP / Solubility
WLOGP
1.64
MLOGP
1.45
XLogP3
1.1
Consensus LogP
1.4
Log S (ESOL)
-2.56
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.57
Class (SILICOS-IT)
Moderately 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)
-3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
3-Chloro-2-(trifluoromethyl)phenylboronic acid
- CAS RN: 1401990-62-2
- Product Code: SSC-050684
-
Eupalinolide H
- CAS RN: 1402067-83-7
- Product Code: starshine_CAS1402067-83-7
- Purity/Analytical method: >99.0%
-
Eupalinolide I
- CAS RN: 1402067-84-8
- Product Code: starshine_CAS1402067-84-8
- Purity/Analytical method: >99.0%
-
-
2-Propenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-
- CAS RN: 1402086-20-7
- Product Code: starshine_CAS1402086-20-7
- Purity/Analytical method: >99.0%
-
L-Glutamine, L-alanyl-L-γ-glutamyl-L-alanyl-
- CAS RN: 1402135-16-3
- Product Code: starshine_CAS1402135-16-3
- Purity/Analytical method: >99.0%
.gif)
.gif)
.gif)
.gif)
![CAS 1402086-20-7 2-Propenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1402086-20-7(2).gif)
.gif)