![CAS 2460687-74-3 Carbamic acid, N-[(1S)-2-[4-amino-5-(aminocarbonyl)-1H-pyrazol-1-yl]-1-methylethyl]-, phenylmethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2460687-74-3.gif)
CAS RN: 2460687-74-3
Carbamic acid, N-[(1S)-2-[4-amino-5-(aminocarbonyl)-1H-pyrazol-1-yl]-1-methylethyl]-, phenylmethyl ester
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.20260619 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2460687-74-3
- Purity/Analytical Methods: >99.0%
2460687-74-3 / benzyl N-[(2S)-1-(4-amino-5-carbamoylpyrazol-1-yl)propan-2-yl]carbamate
Basic Information
CAS
2460687-74-3
Multi CAS
No
Molecular Formula
C15H19N5O3
Molecular Weight
317.340000
Exact Mass
317.148789
SMILES
C[C@@H](CN1C(=C(C=N1)N)C(=O)N)NC(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C15H19N5O3/c1-10(8-20-13(14(17)21)12(16)7-18-20)19-15(22)23-9-11-5-3-2-4-6-11/h2-7,10H,8-9,16H2,1H3,(H2,17,21)(H,19,22)/t10-/m0/s1
InChIKey
UWVMOCVSUAXXGB-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
11
Fraction Csp3
0.27
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
3
Molar refractivity
84.38
TPSA
125.26
LogP / Solubility
WLOGP
0.88
MLOGP
0.79
XLogP3
0.9
Consensus LogP
0.86
Log S (ESOL)
-2.32
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.8
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.17
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
Customers Also Viewed
-
1-Piperidinecarboxylic acid, 3-fluoro-5-hydroxy-, 1,1-dimethylethyl ester, (3S,5R)-
- CAS RN: 2460740-52-5
- Product Code: SSC-119462
-
(R)-1-(4-Bromo-2,6-difluorophenyl)ethan-1-amine hydrochloride
- CAS RN: 2460740-58-1
- Product Code: starshine_CAS2460740-58-1
- Purity/Analytical method: >99.0%
-
1H-Pyrazolo[4,3-c]pyridine, 3-bromo-4,5,6,7-tetrahydro-, hydrochloride (1:2)
- CAS RN: 2460757-28-0
- Product Code: starshine_CAS2460757-28-0
- Purity/Analytical method: >99.0%
-
-
Acetic acid, 2-[[2-(2,6-dioxo-3-piperidinyl)-2,3-dihydro-1,3-dioxo-1H-isoindol-5-yl]oxy]-
- CAS RN: 2467425-53-0
- Product Code: SSC-119601
-
1H-Indole-2-carboxamide, 4-methoxy-N-[(1S)-3-methyl-1-[[[(1S)-2-oxo-1-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]-3-(phosphonooxy)propyl]amino]carbonyl]butyl]-
- CAS RN: 2468015-78-1
- Product Code: starshine_CAS2468015-78-1
- Purity/Analytical method: >99.0%
![CAS 2460757-28-0 1H-Pyrazolo[4,3-c]pyridine, 3-bromo-4,5,6,7-tetrahydro-, hydrochloride (1:2) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2460757-28-0.gif)
![CAS 2467425-53-0 Acetic acid, 2-[[2-(2,6-dioxo-3-piperidinyl)-2,3-dihydro-1,3-dioxo-1H-isoindol-5-yl]oxy]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2467425-53-0.gif)
![CAS 2468015-78-1 1H-Indole-2-carboxamide, 4-methoxy-N-[(1S)-3-methyl-1-[[[(1S)-2-oxo-1-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]-3-(phosphonooxy)propyl]amino]carbonyl]butyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2468015-78-1.gif)