(S,R,S)-Ahpc-peg1-NH2
기본 정보
- CAS
2241641-57-4- 표준 SMILES
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCN)C(C)(C)C)cc1- InChIKey
PSFPAHIYWIEFHI-ZRCGQRJVSA-N- 분자식
- C26H37N5O5S
- 평균 분자량
- 531.7 g/mol
이름 및 식별자
- 우선 이름
- (S,R,S)-Ahpc-peg1-NH2
- IUPAC
- (2S,4R)-1-[(2S)-2-[[2-(2-aminoethoxy)acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide
- 영어명
- L-Prolinamide, N-[2-(2-aminoethoxy)acetyl]-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-
- 분자식
- C26H37N5O5S
- 분자량
- 531.67
이름 및 동의어
2241641-57-4(S,R,S)-AHPC-PEG1-NH2(2S,4R)-1-((S)-2-(2-(2-aminoethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamideMFCD32173010(S,R,S)-AHPC-acetamido-O-C2-amine HCl(2S,4R)-1-[(2S)-2-[[2-(2-aminoethoxy)acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide(2S,4R)-1-[(S)-2-[2-(2-Aminoethoxy)acetamido]-3,3-dimethylbutanoyl]-4-hydroxy-N-[4-(4-methylthiazol-5-yl)benzyl]pyrrolidine-2-carboxamideorb1984607SCHEMBL21068873C26H37N5O5SAKOS040757453DA-69289
이름 더 보기
VH032-PEG1-NH2L-Prolinamide, N-[2-(2-aminoethoxy)acetyl]-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-(2S,4R)-1-[(2S)-2-[2-(2-aminoethoxy)acetamido]-3,3-dimethylbutanoyl]-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}pyrrolidine-2-carboxamide
PD046004SY500286HY-136008CS-0119154G63276T39735(2S,4R)-1-[(2S)-2-[[2-(2-aminoethoxy)acetyl]amino]-3,3-dimethyl-butanoyl]-4-hydroxy-N-[[4-(4-methylthiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide
데이터베이스 식별자
- CAS
2241641-57-4
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 175 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 786
물리화학적 성질
- 끓는 점
- 835 · 835.0±65.0 °C(Predicted)
- 밀도
- 1.261 · 1.261±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.56 · 13.56±0.46(Predicted)
관련 반응
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