CS-0002257
1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-, 1-(1,1-dimethylethyl) ester
Manufacturer: ChemScene
CAS Number: 519148-74-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₂₆BN₃O₆S
Molecular Weight
423.29
Synonyms
2-BORONO-5-[(4-METHYL-(PIPERAZIN-1-YL))SULFONYL]-1H-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
SMILES
O=S(N(CC1)CCN1C)(C2=CC3=C(C=C2)N(C(OC(C)(C)C)=O)C(B(O)O)=C3)=O
Tpsa
112.31
Logp
0.0404
H Acceptors
8
H Donors
2
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 519148-74-4 | 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-, 1-(1,1-dimethylethyl) ester | A2B Chem | -- |
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Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₆BN₃O₆S
Molecular Weight: 423.29
Synonyms: 2-BORONO-5-[(4-METHYL-(PIPERAZIN-1-YL))SULFONYL]-1H-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
SMILES: O=S(N(CC1)CCN1C)(C2=CC3=C(C=C2)N(C(OC(C)(C)C)=O)C(B(O)O)=C3)=O
Tpsa: 112.31
Logp: 0.0404
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₆BN₃O₆S
Molecular Weight:
423.29
Synonyms:
2-BORONO-5-[(4-METHYL-(PIPERAZIN-1-YL))SULFONYL]-1H-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
SMILES:
O=S(N(CC1)CCN1C)(C2=CC3=C(C=C2)N(C(OC(C)(C)C)=O)C(B(O)O)=C3)=O
Tpsa:
112.31
Logp:
0.0404
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₃₀BNO₅Si
Molecular Weight: 391.34
Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-[[[dimethyl(1-methylethyl)silyl]oxy]methyl]-, 1-(1,1-dimethylethyl) ester (9CI)
SMILES: O=C(OC(C)(C)C)N1C(B(O)O)=CC2=C1C=CC(CO[Si](C)(C)C(C)C)=C2
Tpsa: 80.92
Logp: 3.236
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₃₀BNO₅Si
Molecular Weight:
391.34
Synonyms:
1H-Indole-1-carboxylic acid, 2-borono-5-[[[dimethyl(1-methylethyl)silyl]oxy]methyl]-, 1-(1,1-dimethylethyl) ester (9CI)
SMILES:
O=C(OC(C)(C)C)N1C(B(O)O)=CC2=C1C=CC(CO[Si](C)(C)C(C)C)=C2
Tpsa:
80.92
Logp:
3.236
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₃₂BNO₅Si
Molecular Weight: 405.37
Synonyms: [1-(tert-Butoxycarbonyl)-6-({[tert-butyl(dimethyl)silyl]oxy}methyl)-1H-indol-2-yl]boronic acid
SMILES: O=C(OC(C)(C)C)N1C(B(O)O)=CC(C=C2)=C1C=C2CO[Si](C)(C)C(C)(C)C
Tpsa: 80.92
Logp: 3.6261
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₂BNO₅Si
Molecular Weight:
405.37
Synonyms:
[1-(tert-Butoxycarbonyl)-6-({[tert-butyl(dimethyl)silyl]oxy}methyl)-1H-indol-2-yl]boronic acid
SMILES:
O=C(OC(C)(C)C)N1C(B(O)O)=CC(C=C2)=C1C=C2CO[Si](C)(C)C(C)(C)C
Tpsa:
80.92
Logp:
3.6261
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 97%
MDL No: MFCD04114578
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₅BN₂O₄
Molecular Weight: 286.09
Synonyms: N-tert-Butoxycarbonyl-5-cyano-1H-indole-2-boronic acid
SMILES: N#CC1=CC2=C(C=C1)N(C(OC(C)(C)C)=O)C(B(O)O)=C2
Tpsa: 95.48
Logp: 0.97598
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD04114578
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅BN₂O₄
Molecular Weight:
286.09
Synonyms:
N-tert-Butoxycarbonyl-5-cyano-1H-indole-2-boronic acid
SMILES:
N#CC1=CC2=C(C=C1)N(C(OC(C)(C)C)=O)C(B(O)O)=C2
Tpsa:
95.48
Logp:
0.97598
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
1