CAS RN: 20105-20-8
Murrastinine C
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.20260328 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS20105-20-8
- Purity/Analytical Methods: >99.0%
20105-20-8 / 3,3-dimethyl-11H-pyrano[3,2-a]carbazole-8-carbaldehyde
Basic Information
CAS
20105-20-8
Multi CAS
No
Molecular Formula
C18H15NO2
Molecular Weight
277.300000
Exact Mass
277.110279
SMILES
CC1(C=CC2=C(O1)C=CC3=C2NC4=C3C=C(C=C4)C=O)C
InChI
InChI=1S/C18H15NO2/c1-18(2)8-7-13-16(21-18)6-4-12-14-9-11(10-20)3-5-15(14)19-17(12)13/h3-10,19H,1-2H3
InChIKey
QTXCJUWYNICVSM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
13
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
84.93
TPSA
42.09
LogP / Solubility
WLOGP
4.32
MLOGP
3.81
XLogP3
3.8
Consensus LogP
3.98
Log S (ESOL)
-4.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.95
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.17
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
![CAS 201054-55-9 Carbamic acid, [(1S,4R)-4-hydroxy-2-cyclopenten-1-yl]-, 1,1-dimethylethyl molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Carbamic acid, [(1S,4R)-4-hydroxy-2-cyclopenten-1-yl]-, 1,1-dimethylethyl
- CAS RN: 201054-55-9
- Product Code: SSC-094878
-
-
HEXAFLUORO-2-(P-TOLYL)ISOPROPANOL
- CAS RN: 2010-61-9
- Product Code: starshine_CAS2010-61-9
- Purity/Analytical method: >99.0%
-
cis-Methylkhellactone
- CAS RN: 20107-13-5
- Product Code: starshine_CAS20107-13-5
- Purity/Analytical method: >99.0%
-
(S)-1,2,3,4-tetrahydronaphthalen-2-ol
- CAS RN: 20107-40-8
- Product Code: starshine_CAS20107-40-8
- Purity/Analytical method: >99.0%
-
FUSICOCCIN
- CAS RN: 20108-30-9
- Product Code: starshine_CAS20108-30-9
- Purity/Analytical method: >99.0%
![CAS 201054-55-9 Carbamic acid, [(1S,4R)-4-hydroxy-2-cyclopenten-1-yl]-, 1,1-dimethylethyl molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/201054-55-9.gif)
