![CAS 848193-72-6 (S)-2-chloro-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-6-carboxaMide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/848193-72-6.gif)
CAS RN: 848193-72-6
(S)-2-chloro-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-6-carboxaMide
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250927 | 1mg / 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS848193-72-6
- Purity/Analytical Methods: >99.0%
848193-72-6 / (6S)-2-chloro-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-6-carboxamide
Basic Information
CAS
848193-72-6
Multi CAS
Yes
Molecular Formula
C14H15CLN2O
Molecular Weight
262.730000
Exact Mass
262.087291
InChI
InChI=1S/C14H15ClN2O/c15-8-5-6-12-11(7-8)9-3-1-2-4-10(14(16)18)13(9)17-12/h5-7,10,17H,1-4H2,(H2,16,18)/t10-/m0/s1
InChIKey
ABIVOOWWGYJNLV-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
9
Fraction Csp3
0.36
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
2
Molar refractivity
72.8
TPSA
58.88
LogP / Solubility
WLOGP
3.12
MLOGP
2.75
XLogP3
3
Consensus LogP
2.96
Log S (ESOL)
-3.74
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.96
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.07
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
Customers Also Viewed
-
![CAS 848217-00-5 8-chloro-2-methyl-4-(4-methylpiperazin-1-yl)-[1]benzofuro[3,2-d]pyrimidine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
8-chloro-2-methyl-4-(4-methylpiperazin-1-yl)-[1]benzofuro[3,2-d]pyrimidine
- CAS RN: 848217-00-5
- Product Code: starshine_CAS848217-00-5
- Purity/Analytical method: >99.0%
-
-
2-ETHOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE
- CAS RN: 848243-23-2
- Product Code: SSC-192475
-
2-ISOPROPOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE
- CAS RN: 848243-25-4
- Product Code: SSC-192476
-
2-CYCLOPROPYLMETHOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE
- CAS RN: 848243-26-5
- Product Code: SSC-192477
-
HS-243
- CAS RN: 848249-10-5
- Product Code: starshine_CAS848249-10-5
- Purity/Analytical method: >99.0%
![CAS 848217-00-5 8-chloro-2-methyl-4-(4-methylpiperazin-1-yl)-[1]benzofuro[3,2-d]pyrimidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/848217-00-5.gif)
![CAS 848243-23-2 2-ETHOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/848243-23-2.gif)
![CAS 848243-25-4 2-ISOPROPOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/848243-25-4.gif)
![CAS 848243-26-5 2-CYCLOPROPYLMETHOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/848243-26-5.gif)
